id	sid	tid	token	lemma	pos
ecletica-1369	1	1	original	original	ADJ
ecletica-1369	1	2	article	article	NOUN
ecletica-1369	1	3	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1369	1	4	|	|	ADJ
ecletica-1369	1	5	vol	vol	NOUN
ecletica-1369	1	6	.	.	PUNCT
ecletica-1369	2	1	47	47	NUM
ecletica-1369	3	1	|	|	ADV
ecletica-1369	3	2	n.	n.	NOUN
ecletica-1369	3	3	4	4	NUM
ecletica-1369	4	1	|	|	ADV
ecletica-1369	4	2	2022	2022	NUM
ecletica-1369	4	3	|	|	ADV
ecletica-1369	4	4	55	55	NUM
ecletica-1369	4	5	eclética	eclética	PROPN
ecletica-1369	4	6	química	química	PROPN
ecletica-1369	4	7	journal	journal	PROPN
ecletica-1369	4	8	,	,	PUNCT
ecletica-1369	4	9	vol	vol	NOUN
ecletica-1369	4	10	.	.	PROPN
ecletica-1369	4	11	47	47	NUM
ecletica-1369	4	12	,	,	PUNCT
ecletica-1369	4	13	n.	n.	NOUN
ecletica-1369	4	14	4	4	NUM
ecletica-1369	4	15	,	,	PUNCT
ecletica-1369	4	16	2022	2022	NUM
ecletica-1369	4	17	,	,	PUNCT
ecletica-1369	4	18	55	55	NUM
ecletica-1369	4	19	-	-	SYM
ecletica-1369	4	20	68	68	NUM
ecletica-1369	4	21	issn	issn	NOUN
ecletica-1369	4	22	:	:	PUNCT
ecletica-1369	4	23	1678	1678	NUM
ecletica-1369	4	24	-	-	SYM
ecletica-1369	4	25	4618	4618	NUM
ecletica-1369	4	26	doi	doi	NOUN
ecletica-1369	4	27	:	:	PUNCT
ecletica-1369	4	28	10.26850/1678	10.26850/1678	NUM
ecletica-1369	4	29	-	-	SYM
ecletica-1369	4	30	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	4	31	-	-	PUNCT
ecletica-1369	4	32	68	68	NUM
ecletica-1369	4	33	structural	structural	ADJ
ecletica-1369	4	34	effect	effect	NOUN
ecletica-1369	4	35	on	on	ADP
ecletica-1369	4	36	the	the	DET
ecletica-1369	4	37	charge	charge	NOUN
ecletica-1369	4	38	transfer	transfer	NOUN
ecletica-1369	4	39	and	and	CCONJ
ecletica-1369	4	40	on	on	ADP
ecletica-1369	4	41	the	the	DET
ecletica-1369	4	42	internal	internal	ADJ
ecletica-1369	4	43	reorganization	reorganization	NOUN
ecletica-1369	4	44	energy	energy	NOUN
ecletica-1369	4	45	:	:	PUNCT
ecletica-1369	4	46	computational	computational	ADJ
ecletica-1369	4	47	study	study	NOUN
ecletica-1369	4	48	mohamed	mohamed	PROPN
ecletica-1369	4	49	jabha1,2	jabha1,2	PROPN
ecletica-1369	4	50	+	+	PROPN
ecletica-1369	4	51	,	,	PUNCT
ecletica-1369	4	52	abdelah	abdelah	ADP
ecletica-1369	4	53	el	el	PROPN
ecletica-1369	4	54	alaoui2	alaoui2	PROPN
ecletica-1369	4	55	,	,	PUNCT
ecletica-1369	4	56	abdellah	abdellah	PROPN
ecletica-1369	4	57	jarid3	jarid3	PROPN
ecletica-1369	4	58	,	,	PUNCT
ecletica-1369	4	59	el	el	PROPN
ecletica-1369	4	60	houssine	houssine	INTJ
ecletica-1369	5	1	mabrouk1,4	mabrouk1,4	PROPN
ecletica-1369	5	2	1	1	NUM
ecletica-1369	5	3	.	.	PUNCT
ecletica-1369	6	1	university	university	NOUN
ecletica-1369	6	2	of	of	ADP
ecletica-1369	6	3	moulay	moulay	PROPN
ecletica-1369	6	4	ismail	ismail	PROPN
ecletica-1369	6	5	,	,	PUNCT
ecletica-1369	6	6	faculty	faculty	NOUN
ecletica-1369	6	7	of	of	ADP
ecletica-1369	6	8	sciences	science	NOUN
ecletica-1369	6	9	and	and	CCONJ
ecletica-1369	6	10	technics	technic	NOUN
ecletica-1369	6	11	,	,	PUNCT
ecletica-1369	6	12	errachidia	errachidia	PROPN
ecletica-1369	6	13	,	,	PUNCT
ecletica-1369	6	14	morocco	morocco	PROPN
ecletica-1369	6	15	.	.	PUNCT
ecletica-1369	7	1	2	2	X
ecletica-1369	7	2	.	.	X
ecletica-1369	7	3	university	university	NOUN
ecletica-1369	7	4	of	of	ADP
ecletica-1369	7	5	moulay	moulay	PROPN
ecletica-1369	7	6	ismail	ismail	PROPN
ecletica-1369	7	7	,	,	PUNCT
ecletica-1369	7	8	faculty	faculty	NOUN
ecletica-1369	7	9	of	of	ADP
ecletica-1369	7	10	sciences	science	NOUN
ecletica-1369	7	11	,	,	PUNCT
ecletica-1369	7	12	meknes	meknes	PROPN
ecletica-1369	7	13	,	,	PUNCT
ecletica-1369	7	14	morocco	morocco	PROPN
ecletica-1369	7	15	.	.	PUNCT
ecletica-1369	8	1	3	3	X
ecletica-1369	8	2	.	.	X
ecletica-1369	8	3	university	university	NOUN
ecletica-1369	8	4	of	of	ADP
ecletica-1369	8	5	cadi	cadi	NOUN
ecletica-1369	8	6	ayyad	ayyad	NOUN
ecletica-1369	8	7	,	,	PUNCT
ecletica-1369	8	8	faculty	faculty	NOUN
ecletica-1369	8	9	of	of	ADP
ecletica-1369	8	10	sciences	science	NOUN
ecletica-1369	8	11	semlalia	semlalia	PROPN
ecletica-1369	8	12	,	,	PUNCT
ecletica-1369	8	13	marrakech	marrakech	NOUN
ecletica-1369	8	14	,	,	PUNCT
ecletica-1369	8	15	morocco	morocco	PROPN
ecletica-1369	8	16	.	.	PUNCT
ecletica-1369	9	1	4	4	X
ecletica-1369	9	2	.	.	X
ecletica-1369	9	3	sidi	sidi	PROPN
ecletica-1369	9	4	mohamed	mohamed	PROPN
ecletica-1369	9	5	ben	ben	PROPN
ecletica-1369	9	6	abdellah	abdellah	PROPN
ecletica-1369	9	7	university	university	PROPN
ecletica-1369	9	8	,	,	PUNCT
ecletica-1369	9	9	faculty	faculty	NOUN
ecletica-1369	9	10	of	of	ADP
ecletica-1369	9	11	sciences	science	NOUN
ecletica-1369	9	12	,	,	PUNCT
ecletica-1369	9	13	fez	fez	NOUN
ecletica-1369	9	14	,	,	PUNCT
ecletica-1369	9	15	morocco	morocco	PROPN
ecletica-1369	9	16	.	.	PUNCT
ecletica-1369	10	1	+	+	PUNCT
ecletica-1369	10	2	corresponding	corresponding	ADJ
ecletica-1369	10	3	author	author	NOUN
ecletica-1369	10	4	:	:	PUNCT
ecletica-1369	10	5	mohamed	mohamed	PROPN
ecletica-1369	10	6	jabha	jabha	PROPN
ecletica-1369	10	7	,	,	PUNCT
ecletica-1369	10	8	phone	phone	NOUN
ecletica-1369	10	9	:	:	PUNCT
ecletica-1369	10	10	+212614018410	+212614018410	ADV
ecletica-1369	10	11	,	,	PUNCT
ecletica-1369	10	12	email	email	NOUN
ecletica-1369	10	13	address	address	NOUN
ecletica-1369	10	14	:	:	PUNCT
ecletica-1369	10	15	m.jabha@edu.umi.ac.ma	m.jabha@edu.umi.ac.ma	PROPN
ecletica-1369	10	16	article	article	NOUN
ecletica-1369	10	17	info	info	NOUN
ecletica-1369	10	18	article	article	NOUN
ecletica-1369	10	19	history	history	NOUN
ecletica-1369	10	20	:	:	PUNCT
ecletica-1369	10	21	received	receive	VERB
ecletica-1369	10	22	:	:	PUNCT
ecletica-1369	10	23	july	july	PROPN
ecletica-1369	10	24	26	26	NUM
ecletica-1369	10	25	,	,	PUNCT
ecletica-1369	10	26	2022	2022	NUM
ecletica-1369	10	27	accepted	accept	VERB
ecletica-1369	10	28	:	:	PUNCT
ecletica-1369	10	29	october	october	PROPN
ecletica-1369	10	30	10	10	NUM
ecletica-1369	10	31	,	,	PUNCT
ecletica-1369	10	32	2022	2022	NUM
ecletica-1369	10	33	published	publish	VERB
ecletica-1369	10	34	:	:	PUNCT
ecletica-1369	10	35	october	october	PROPN
ecletica-1369	10	36	28	28	NUM
ecletica-1369	10	37	,	,	PUNCT
ecletica-1369	10	38	2022	2022	NUM
ecletica-1369	10	39	keywords	keyword	NOUN
ecletica-1369	10	40	:	:	PUNCT
ecletica-1369	10	41	1	1	NUM
ecletica-1369	10	42	.	.	X
ecletica-1369	10	43	2.7	2.7	NUM
ecletica-1369	10	44	-	-	PUNCT
ecletica-1369	10	45	divinylcarbazole	divinylcarbazole	NOUN
ecletica-1369	10	46	2	2	NUM
ecletica-1369	10	47	.	.	PUNCT
ecletica-1369	10	48	benzo	benzo	NOUN
ecletica-1369	10	49	-	-	PUNCT
ecletica-1369	10	50	bis	bis	NOUN
ecletica-1369	10	51	-	-	NOUN
ecletica-1369	10	52	thiadiazole	thiadiazole	NOUN
ecletica-1369	10	53	3	3	NUM
ecletica-1369	10	54	.	.	PUNCT
ecletica-1369	11	1	photovoltaic	photovoltaic	NOUN
ecletica-1369	11	2	cell	cell	NOUN
ecletica-1369	11	3	4	4	NUM
ecletica-1369	11	4	.	.	PUNCT
ecletica-1369	11	5	dft	dft	PROPN
ecletica-1369	11	6	5	5	NUM
ecletica-1369	11	7	.	.	PUNCT
ecletica-1369	11	8	charge	charge	NOUN
ecletica-1369	11	9	transfer	transfer	NOUN
ecletica-1369	11	10	section	section	NOUN
ecletica-1369	11	11	editors	editor	NOUN
ecletica-1369	11	12	:	:	PUNCT
ecletica-1369	11	13	assis	assis	PROPN
ecletica-1369	11	14	vicente	vicente	PROPN
ecletica-1369	11	15	benedetti	benedetti	PROPN
ecletica-1369	11	16	abstract	abstract	PROPN
ecletica-1369	11	17	:	:	PUNCT
ecletica-1369	11	18	the	the	DET
ecletica-1369	11	19	effects	effect	NOUN
ecletica-1369	11	20	of	of	ADP
ecletica-1369	11	21	addition	addition	NOUN
ecletica-1369	11	22	of	of	ADP
ecletica-1369	11	23	thiophene	thiophene	NOUN
ecletica-1369	11	24	,	,	PUNCT
ecletica-1369	11	25	bridged	bridged	ADJ
ecletica-1369	11	26	phenyl	phenyl	NOUN
ecletica-1369	11	27	-	-	PUNCT
ecletica-1369	11	28	thiophene	thiophene	NOUN
ecletica-1369	11	29	,	,	PUNCT
ecletica-1369	11	30	thia	thia	NOUN
ecletica-1369	11	31	-	-	PUNCT
ecletica-1369	11	32	tetra	tetra	NOUN
ecletica-1369	11	33	-	-	PUNCT
ecletica-1369	11	34	azacyclopenta	azacyclopenta	NOUN
ecletica-1369	11	35	-	-	PUNCT
ecletica-1369	11	36	naphthalene	naphthalene	NOUN
ecletica-1369	11	37	,	,	PUNCT
ecletica-1369	11	38	benzobis	benzobis	NOUN
ecletica-1369	11	39	-	-	PUNCT
ecletica-1369	11	40	thiadiazole	thiadiazole	NOUN
ecletica-1369	11	41	,	,	PUNCT
ecletica-1369	11	42	and	and	CCONJ
ecletica-1369	11	43	pyrido(3,4	pyrido(3,4	ADJ
ecletica-1369	11	44	-	-	PUNCT
ecletica-1369	11	45	b)pyrazine	b)pyrazine	NOUN
ecletica-1369	11	46	to	to	ADP
ecletica-1369	11	47	9-(4	9-(4	PROPN
ecletica-1369	11	48	-	-	PUNCT
ecletica-1369	11	49	octyloxyphenyl)-2,7	octyloxyphenyl)-2,7	NOUN
ecletica-1369	11	50	-	-	PUNCT
ecletica-1369	11	51	divinylcabazole	divinylcabazole	NOUN
ecletica-1369	11	52	on	on	ADP
ecletica-1369	11	53	the	the	DET
ecletica-1369	11	54	internal	internal	ADJ
ecletica-1369	11	55	reorganization	reorganization	NOUN
ecletica-1369	11	56	energies	energy	NOUN
ecletica-1369	11	57	,	,	PUNCT
ecletica-1369	11	58	electronic	electronic	ADJ
ecletica-1369	11	59	affinity	affinity	NOUN
ecletica-1369	11	60	,	,	PUNCT
ecletica-1369	11	61	and	and	CCONJ
ecletica-1369	11	62	ionization	ionization	NOUN
ecletica-1369	11	63	potential	potential	NOUN
ecletica-1369	11	64	were	be	AUX
ecletica-1369	11	65	studied	study	VERB
ecletica-1369	11	66	using	use	VERB
ecletica-1369	11	67	density	density	NOUN
ecletica-1369	11	68	functional	functional	ADJ
ecletica-1369	11	69	theory	theory	NOUN
ecletica-1369	11	70	(	(	PUNCT
ecletica-1369	11	71	dft	dft	PROPN
ecletica-1369	11	72	)	)	PUNCT
ecletica-1369	11	73	.	.	PUNCT
ecletica-1369	12	1	these	these	DET
ecletica-1369	12	2	compounds	compound	NOUN
ecletica-1369	12	3	are	be	AUX
ecletica-1369	12	4	characterized	characterize	VERB
ecletica-1369	12	5	by	by	ADP
ecletica-1369	12	6	their	their	PRON
ecletica-1369	12	7	charge	charge	NOUN
ecletica-1369	12	8	exchange	exchange	NOUN
ecletica-1369	12	9	potentials	potential	NOUN
ecletica-1369	12	10	(	(	PUNCT
ecletica-1369	12	11	donor	donor	NOUN
ecletica-1369	12	12	-	-	PUNCT
ecletica-1369	12	13	acceptor	acceptor	NOUN
ecletica-1369	12	14	)	)	PUNCT
ecletica-1369	12	15	,	,	PUNCT
ecletica-1369	12	16	which	which	PRON
ecletica-1369	12	17	can	can	AUX
ecletica-1369	12	18	be	be	AUX
ecletica-1369	12	19	applied	apply	VERB
ecletica-1369	12	20	in	in	ADP
ecletica-1369	12	21	energy	energy	NOUN
ecletica-1369	12	22	conversion	conversion	NOUN
ecletica-1369	12	23	devices	device	NOUN
ecletica-1369	12	24	such	such	ADJ
ecletica-1369	12	25	as	as	ADP
ecletica-1369	12	26	photovoltaic	photovoltaic	NOUN
ecletica-1369	12	27	cells	cell	NOUN
ecletica-1369	12	28	.	.	PUNCT
ecletica-1369	13	1	the	the	DET
ecletica-1369	13	2	so	so	ADV
ecletica-1369	13	3	-	-	PUNCT
ecletica-1369	13	4	called	call	VERB
ecletica-1369	13	5	internal	internal	ADJ
ecletica-1369	13	6	reorganization	reorganization	NOUN
ecletica-1369	13	7	concerns	concern	NOUN
ecletica-1369	13	8	,	,	PUNCT
ecletica-1369	13	9	above	above	ADP
ecletica-1369	13	10	all	all	PRON
ecletica-1369	13	11	,	,	PUNCT
ecletica-1369	13	12	the	the	DET
ecletica-1369	13	13	positions	position	NOUN
ecletica-1369	13	14	of	of	ADP
ecletica-1369	13	15	holes	hole	NOUN
ecletica-1369	13	16	and	and	CCONJ
ecletica-1369	13	17	points	point	NOUN
ecletica-1369	13	18	of	of	ADP
ecletica-1369	13	19	high	high	ADJ
ecletica-1369	13	20	electron	electron	NOUN
ecletica-1369	13	21	density	density	NOUN
ecletica-1369	13	22	on	on	ADP
ecletica-1369	13	23	the	the	DET
ecletica-1369	13	24	molecular	molecular	ADJ
ecletica-1369	13	25	skeleton	skeleton	NOUN
ecletica-1369	13	26	.	.	PUNCT
ecletica-1369	14	1	thus	thus	ADV
ecletica-1369	14	2	,	,	PUNCT
ecletica-1369	14	3	valuable	valuable	ADJ
ecletica-1369	14	4	information	information	NOUN
ecletica-1369	14	5	is	be	AUX
ecletica-1369	14	6	provided	provide	VERB
ecletica-1369	14	7	by	by	ADP
ecletica-1369	14	8	the	the	DET
ecletica-1369	14	9	knowledge	knowledge	NOUN
ecletica-1369	14	10	of	of	ADP
ecletica-1369	14	11	the	the	DET
ecletica-1369	14	12	structure	structure	NOUN
ecletica-1369	14	13	,	,	PUNCT
ecletica-1369	14	14	the	the	DET
ecletica-1369	14	15	length	length	NOUN
ecletica-1369	14	16	of	of	ADP
ecletica-1369	14	17	the	the	DET
ecletica-1369	14	18	desired	desire	VERB
ecletica-1369	14	19	oligomer	oligomer	NOUN
ecletica-1369	14	20	and	and	CCONJ
ecletica-1369	14	21	the	the	DET
ecletica-1369	14	22	nature	nature	NOUN
ecletica-1369	14	23	of	of	ADP
ecletica-1369	14	24	the	the	DET
ecletica-1369	14	25	radicals	radical	NOUN
ecletica-1369	14	26	attached	attach	VERB
ecletica-1369	14	27	to	to	ADP
ecletica-1369	14	28	the	the	DET
ecletica-1369	14	29	oligomer	oligomer	NOUN
ecletica-1369	14	30	.	.	PUNCT
ecletica-1369	15	1	considering	consider	VERB
ecletica-1369	15	2	the	the	DET
ecletica-1369	15	3	available	available	ADJ
ecletica-1369	15	4	data	datum	NOUN
ecletica-1369	15	5	,	,	PUNCT
ecletica-1369	15	6	2,7	2,7	NUM
ecletica-1369	15	7	-	-	NOUN
ecletica-1369	15	8	divnylcarbazole	divnylcarbazole	NOUN
ecletica-1369	15	9	(	(	PUNCT
ecletica-1369	15	10	crv	crv	PROPN
ecletica-1369	15	11	-	-	PUNCT
ecletica-1369	15	12	h	h	NOUN
ecletica-1369	15	13	)	)	PUNCT
ecletica-1369	15	14	is	be	AUX
ecletica-1369	15	15	the	the	DET
ecletica-1369	15	16	basic	basic	ADJ
ecletica-1369	15	17	oligomer	oligomer	NOUN
ecletica-1369	15	18	to	to	PART
ecletica-1369	15	19	carry	carry	VERB
ecletica-1369	15	20	out	out	ADP
ecletica-1369	15	21	this	this	DET
ecletica-1369	15	22	theoretical	theoretical	ADJ
ecletica-1369	15	23	study	study	NOUN
ecletica-1369	15	24	by	by	ADP
ecletica-1369	15	25	extending	extend	VERB
ecletica-1369	15	26	the	the	DET
ecletica-1369	15	27	choice	choice	NOUN
ecletica-1369	15	28	of	of	ADP
ecletica-1369	15	29	ligands	ligand	NOUN
ecletica-1369	15	30	and	and	CCONJ
ecletica-1369	15	31	length	length	NOUN
ecletica-1369	15	32	order	order	NOUN
ecletica-1369	15	33	to	to	ADP
ecletica-1369	15	34	other	other	ADJ
ecletica-1369	15	35	oligomers	oligomer	NOUN
ecletica-1369	15	36	while	while	SCONJ
ecletica-1369	15	37	setting	set	VERB
ecletica-1369	15	38	charge	charge	NOUN
ecletica-1369	15	39	mobility	mobility	NOUN
ecletica-1369	15	40	as	as	ADP
ecletica-1369	15	41	the	the	DET
ecletica-1369	15	42	major	major	ADJ
ecletica-1369	15	43	objective	objective	NOUN
ecletica-1369	15	44	.	.	PUNCT
ecletica-1369	16	1	the	the	DET
ecletica-1369	16	2	λ+	λ+	X
ecletica-1369	16	3	of	of	ADP
ecletica-1369	16	4	all	all	DET
ecletica-1369	16	5	the	the	DET
ecletica-1369	16	6	oligomers	oligomer	NOUN
ecletica-1369	16	7	studied	study	VERB
ecletica-1369	16	8	was	be	AUX
ecletica-1369	16	9	lower	low	ADJ
ecletica-1369	16	10	than	than	ADP
ecletica-1369	16	11	their	their	PRON
ecletica-1369	16	12	λ	λ	NOUN
ecletica-1369	16	13	–	–	PUNCT
ecletica-1369	16	14	except	except	SCONJ
ecletica-1369	16	15	for	for	ADP
ecletica-1369	16	16	the	the	DET
ecletica-1369	16	17	crv	crv	PROPN
ecletica-1369	16	18	-	-	PUNCT
ecletica-1369	16	19	bbt	bbt	PROPN
ecletica-1369	16	20	oligomer	oligomer	NOUN
ecletica-1369	16	21	,	,	PUNCT
ecletica-1369	16	22	indicating	indicate	VERB
ecletica-1369	16	23	a	a	DET
ecletica-1369	16	24	lower	low	ADJ
ecletica-1369	16	25	hole	hole	NOUN
ecletica-1369	16	26	transfer	transfer	NOUN
ecletica-1369	16	27	cost	cost	NOUN
ecletica-1369	16	28	than	than	ADP
ecletica-1369	16	29	electron	electron	NOUN
ecletica-1369	16	30	transfer	transfer	NOUN
ecletica-1369	16	31	cost	cost	NOUN
ecletica-1369	16	32	with	with	ADP
ecletica-1369	16	33	changes	change	NOUN
ecletica-1369	16	34	in	in	ADP
ecletica-1369	16	35	molecular	molecular	ADJ
ecletica-1369	16	36	geometry	geometry	NOUN
ecletica-1369	16	37	during	during	ADP
ecletica-1369	16	38	this	this	DET
ecletica-1369	16	39	process	process	NOUN
ecletica-1369	16	40	.	.	PUNCT
ecletica-1369	17	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	17	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	PROPN
ecletica-1369	17	3	mailto:m.jabha@edu.umi.ac.ma	mailto:m.jabha@edu.umi.ac.ma	PROPN
ecletica-1369	17	4	https://orcid.org/0000-0002-8070-8521	https://orcid.org/0000-0002-8070-8521	VERB
ecletica-1369	17	5	https://orcid.org/0000-0003-0392-9467	https://orcid.org/0000-0003-0392-9467	PROPN
ecletica-1369	17	6	https://orcid.org/0000-0002-9837-1816	https://orcid.org/0000-0002-9837-1816	PROPN
ecletica-1369	17	7	https://orcid.org/0000-0003-1235-479x	https://orcid.org/0000-0003-1235-479x	VERB
ecletica-1369	17	8	original	original	ADJ
ecletica-1369	17	9	article	article	NOUN
ecletica-1369	17	10	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1369	17	11	56	56	NUM
ecletica-1369	17	12	eclética	eclética	PROPN
ecletica-1369	17	13	química	química	PROPN
ecletica-1369	17	14	journal	journal	PROPN
ecletica-1369	17	15	,	,	PUNCT
ecletica-1369	17	16	vol	vol	NOUN
ecletica-1369	17	17	.	.	PROPN
ecletica-1369	18	1	47	47	NUM
ecletica-1369	18	2	,	,	PUNCT
ecletica-1369	18	3	n.	n.	NOUN
ecletica-1369	18	4	4	4	NUM
ecletica-1369	18	5	,	,	PUNCT
ecletica-1369	18	6	2022	2022	NUM
ecletica-1369	18	7	,	,	PUNCT
ecletica-1369	18	8	55	55	NUM
ecletica-1369	18	9	-	-	SYM
ecletica-1369	18	10	68	68	NUM
ecletica-1369	18	11	issn	issn	NOUN
ecletica-1369	18	12	:	:	PUNCT
ecletica-1369	18	13	1678	1678	NUM
ecletica-1369	18	14	-	-	SYM
ecletica-1369	18	15	4618	4618	NUM
ecletica-1369	18	16	doi	doi	NOUN
ecletica-1369	18	17	:	:	PUNCT
ecletica-1369	18	18	10.26850/1678	10.26850/1678	NUM
ecletica-1369	18	19	-	-	SYM
ecletica-1369	18	20	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	18	21	-	-	PUNCT
ecletica-1369	18	22	68	68	NUM
ecletica-1369	18	23	1	1	NUM
ecletica-1369	18	24	.	.	PUNCT
ecletica-1369	19	1	introduction	introduction	NOUN
ecletica-1369	19	2	the	the	DET
ecletica-1369	19	3	advent	advent	NOUN
ecletica-1369	19	4	of	of	ADP
ecletica-1369	19	5	organic	organic	ADJ
ecletica-1369	19	6	electronics	electronic	NOUN
ecletica-1369	19	7	is	be	AUX
ecletica-1369	19	8	deeply	deeply	ADV
ecletica-1369	19	9	related	relate	VERB
ecletica-1369	19	10	to	to	ADP
ecletica-1369	19	11	the	the	DET
ecletica-1369	19	12	development	development	NOUN
ecletica-1369	19	13	of	of	ADP
ecletica-1369	19	14	new	new	ADJ
ecletica-1369	19	15	oligomers	oligomer	NOUN
ecletica-1369	19	16	with	with	ADP
ecletica-1369	19	17	high	high	ADJ
ecletica-1369	19	18	performance	performance	NOUN
ecletica-1369	19	19	and	and	CCONJ
ecletica-1369	19	20	reproducible	reproducible	ADJ
ecletica-1369	19	21	properties	property	NOUN
ecletica-1369	19	22	(	(	PUNCT
ecletica-1369	19	23	muth	muth	PROPN
ecletica-1369	19	24	et	et	PROPN
ecletica-1369	19	25	al	al	PROPN
ecletica-1369	19	26	.	.	PROPN
ecletica-1369	19	27	,	,	PUNCT
ecletica-1369	19	28	2013	2013	NUM
ecletica-1369	19	29	;	;	PUNCT
ecletica-1369	19	30	rodríguez	rodríguez	NOUN
ecletica-1369	19	31	-	-	PUNCT
ecletica-1369	19	32	monge	monge	PROPN
ecletica-1369	19	33	and	and	CCONJ
ecletica-1369	19	34	larsson	larsson	PROPN
ecletica-1369	19	35	,	,	PUNCT
ecletica-1369	19	36	1995	1995	NUM
ecletica-1369	19	37	)	)	PUNCT
ecletica-1369	19	38	.	.	PUNCT
ecletica-1369	20	1	thus	thus	ADV
ecletica-1369	20	2	,	,	PUNCT
ecletica-1369	20	3	the	the	DET
ecletica-1369	20	4	design	design	NOUN
ecletica-1369	20	5	of	of	ADP
ecletica-1369	20	6	new	new	ADJ
ecletica-1369	20	7	oligomer	oligomer	ADJ
ecletica-1369	20	8	architectures	architecture	NOUN
ecletica-1369	20	9	is	be	AUX
ecletica-1369	20	10	a	a	DET
ecletica-1369	20	11	task	task	NOUN
ecletica-1369	20	12	usually	usually	ADV
ecletica-1369	20	13	accompanied	accompany	VERB
ecletica-1369	20	14	by	by	ADP
ecletica-1369	20	15	difficulties	difficulty	NOUN
ecletica-1369	20	16	,	,	PUNCT
ecletica-1369	20	17	especially	especially	ADV
ecletica-1369	20	18	the	the	DET
ecletica-1369	20	19	molecular	molecular	ADJ
ecletica-1369	20	20	stability	stability	NOUN
ecletica-1369	20	21	that	that	PRON
ecletica-1369	20	22	should	should	AUX
ecletica-1369	20	23	generate	generate	VERB
ecletica-1369	20	24	the	the	DET
ecletica-1369	20	25	reproducible	reproducible	ADJ
ecletica-1369	20	26	properties	property	NOUN
ecletica-1369	20	27	.	.	PUNCT
ecletica-1369	21	1	oligomers	oligomer	NOUN
ecletica-1369	21	2	based	base	VERB
ecletica-1369	21	3	on	on	ADP
ecletica-1369	21	4	2,7	2,7	NUM
ecletica-1369	21	5	-	-	NOUN
ecletica-1369	21	6	divinylcarbazole	divinylcarbazole	NOUN
ecletica-1369	21	7	have	have	AUX
ecletica-1369	21	8	been	be	AUX
ecletica-1369	21	9	the	the	DET
ecletica-1369	21	10	subject	subject	NOUN
ecletica-1369	21	11	of	of	ADP
ecletica-1369	21	12	much	much	ADJ
ecletica-1369	21	13	experimental	experimental	ADJ
ecletica-1369	21	14	and	and	CCONJ
ecletica-1369	21	15	theoretical	theoretical	ADJ
ecletica-1369	21	16	work	work	NOUN
ecletica-1369	21	17	(	(	PUNCT
ecletica-1369	21	18	huixia	huixia	NOUN
ecletica-1369	21	19	et	et	PROPN
ecletica-1369	21	20	al	al	PROPN
ecletica-1369	21	21	.	.	PROPN
ecletica-1369	21	22	,	,	PUNCT
ecletica-1369	21	23	2017	2017	NUM
ecletica-1369	21	24	;	;	PUNCT
ecletica-1369	21	25	jabha	jabha	PROPN
ecletica-1369	21	26	et	et	PROPN
ecletica-1369	21	27	al	al	PROPN
ecletica-1369	21	28	.	.	PROPN
ecletica-1369	21	29	,	,	PUNCT
ecletica-1369	21	30	2018	2018	NUM
ecletica-1369	21	31	;	;	PUNCT
ecletica-1369	21	32	2021	2021	NUM
ecletica-1369	21	33	;	;	PUNCT
ecletica-1369	21	34	leclerc	leclerc	PROPN
ecletica-1369	21	35	et	et	PROPN
ecletica-1369	21	36	al	al	PROPN
ecletica-1369	21	37	.	.	PROPN
ecletica-1369	21	38	,	,	PUNCT
ecletica-1369	21	39	2006	2006	NUM
ecletica-1369	21	40	)	)	PUNCT
ecletica-1369	21	41	.	.	PUNCT
ecletica-1369	22	1	they	they	PRON
ecletica-1369	22	2	have	have	AUX
ecletica-1369	22	3	been	be	AUX
ecletica-1369	22	4	qualified	qualified	ADJ
ecletica-1369	22	5	as	as	ADP
ecletica-1369	22	6	promising	promise	VERB
ecletica-1369	22	7	compounds	compound	NOUN
ecletica-1369	22	8	.	.	PUNCT
ecletica-1369	23	1	thus	thus	ADV
ecletica-1369	23	2	,	,	PUNCT
ecletica-1369	23	3	taking	take	VERB
ecletica-1369	23	4	into	into	ADP
ecletica-1369	23	5	account	account	NOUN
ecletica-1369	23	6	the	the	DET
ecletica-1369	23	7	available	available	ADJ
ecletica-1369	23	8	data	datum	NOUN
ecletica-1369	23	9	of	of	ADP
ecletica-1369	23	10	this	this	DET
ecletica-1369	23	11	nanostructure	nanostructure	NOUN
ecletica-1369	23	12	,	,	PUNCT
ecletica-1369	23	13	a	a	DET
ecletica-1369	23	14	theoretical	theoretical	ADJ
ecletica-1369	23	15	approach	approach	NOUN
ecletica-1369	23	16	would	would	AUX
ecletica-1369	23	17	allow	allow	VERB
ecletica-1369	23	18	to	to	PART
ecletica-1369	23	19	widen	widen	VERB
ecletica-1369	23	20	the	the	DET
ecletica-1369	23	21	field	field	NOUN
ecletica-1369	23	22	of	of	ADP
ecletica-1369	23	23	stakes	stake	NOUN
ecletica-1369	23	24	for	for	ADP
ecletica-1369	23	25	applications	application	NOUN
ecletica-1369	23	26	in	in	ADP
ecletica-1369	23	27	electronics	electronic	NOUN
ecletica-1369	23	28	,	,	PUNCT
ecletica-1369	23	29	optoelectronics	optoelectronic	NOUN
ecletica-1369	23	30	and	and	CCONJ
ecletica-1369	23	31	light	light	ADJ
ecletica-1369	23	32	energy	energy	NOUN
ecletica-1369	23	33	-	-	PUNCT
ecletica-1369	23	34	electric	electric	ADJ
ecletica-1369	23	35	energy	energy	NOUN
ecletica-1369	23	36	conversion	conversion	NOUN
ecletica-1369	23	37	.	.	PUNCT
ecletica-1369	24	1	thus	thus	ADV
ecletica-1369	24	2	,	,	PUNCT
ecletica-1369	24	3	a	a	DET
ecletica-1369	24	4	quantum	quantum	ADJ
ecletica-1369	24	5	treatment	treatment	NOUN
ecletica-1369	24	6	by	by	ADP
ecletica-1369	24	7	means	mean	NOUN
ecletica-1369	24	8	of	of	ADP
ecletica-1369	24	9	the	the	DET
ecletica-1369	24	10	density	density	NOUN
ecletica-1369	24	11	functional	functional	ADJ
ecletica-1369	24	12	theory	theory	NOUN
ecletica-1369	24	13	(	(	PUNCT
ecletica-1369	24	14	dft	dft	NOUN
ecletica-1369	24	15	)	)	PUNCT
ecletica-1369	24	16	seems	seem	VERB
ecletica-1369	24	17	to	to	PART
ecletica-1369	24	18	be	be	AUX
ecletica-1369	24	19	a	a	DET
ecletica-1369	24	20	good	good	ADJ
ecletica-1369	24	21	way	way	NOUN
ecletica-1369	24	22	to	to	PART
ecletica-1369	24	23	understand	understand	VERB
ecletica-1369	24	24	the	the	DET
ecletica-1369	24	25	relationship	relationship	NOUN
ecletica-1369	24	26	between	between	ADP
ecletica-1369	24	27	the	the	DET
ecletica-1369	24	28	structures	structure	NOUN
ecletica-1369	24	29	and	and	CCONJ
ecletica-1369	24	30	the	the	DET
ecletica-1369	24	31	electronic	electronic	ADJ
ecletica-1369	24	32	properties	property	NOUN
ecletica-1369	24	33	mentioned	mention	VERB
ecletica-1369	24	34	above	above	ADV
ecletica-1369	24	35	.	.	PUNCT
ecletica-1369	25	1	studies	study	NOUN
ecletica-1369	25	2	such	such	ADJ
ecletica-1369	25	3	as	as	ADP
ecletica-1369	25	4	the	the	DET
ecletica-1369	25	5	one	one	NOUN
ecletica-1369	25	6	realized	realize	VERB
ecletica-1369	25	7	by	by	ADP
ecletica-1369	25	8	aly	aly	PROPN
ecletica-1369	25	9	(	(	PUNCT
ecletica-1369	25	10	2009	2009	NUM
ecletica-1369	25	11	)	)	PUNCT
ecletica-1369	25	12	show	show	VERB
ecletica-1369	25	13	that	that	SCONJ
ecletica-1369	25	14	carbazole	carbazole	NOUN
ecletica-1369	25	15	units	unit	NOUN
ecletica-1369	25	16	have	have	VERB
ecletica-1369	25	17	properties	property	NOUN
ecletica-1369	25	18	(	(	PUNCT
ecletica-1369	25	19	high	high	ADJ
ecletica-1369	25	20	thermal	thermal	ADJ
ecletica-1369	25	21	stability	stability	NOUN
ecletica-1369	25	22	,	,	PUNCT
ecletica-1369	25	23	excellent	excellent	ADJ
ecletica-1369	25	24	physicochemical	physicochemical	ADJ
ecletica-1369	25	25	,	,	PUNCT
ecletica-1369	25	26	and	and	CCONJ
ecletica-1369	25	27	charge	charge	VERB
ecletica-1369	25	28	hole	hole	NOUN
ecletica-1369	25	29	transport	transport	NOUN
ecletica-1369	25	30	properties	property	NOUN
ecletica-1369	25	31	)	)	PUNCT
ecletica-1369	25	32	.	.	PUNCT
ecletica-1369	26	1	similarly	similarly	ADV
ecletica-1369	26	2	,	,	PUNCT
ecletica-1369	26	3	derivatives	derivative	NOUN
ecletica-1369	26	4	of	of	ADP
ecletica-1369	26	5	carbazole	carbazole	NOUN
ecletica-1369	26	6	have	have	AUX
ecletica-1369	26	7	been	be	AUX
ecletica-1369	26	8	analyzed	analyze	VERB
ecletica-1369	26	9	by	by	ADP
ecletica-1369	26	10	chemical	chemical	NOUN
ecletica-1369	26	11	modification	modification	NOUN
ecletica-1369	26	12	(	(	PUNCT
ecletica-1369	26	13	jabha	jabha	PROPN
ecletica-1369	26	14	et	et	PROPN
ecletica-1369	26	15	al	al	PROPN
ecletica-1369	26	16	.	.	PROPN
ecletica-1369	26	17	,	,	PUNCT
ecletica-1369	26	18	2018	2018	NUM
ecletica-1369	26	19	)	)	PUNCT
ecletica-1369	26	20	.	.	PUNCT
ecletica-1369	27	1	in	in	ADP
ecletica-1369	27	2	general	general	ADJ
ecletica-1369	27	3	,	,	PUNCT
ecletica-1369	27	4	oligomers	oligomer	NOUN
ecletica-1369	27	5	and	and	CCONJ
ecletica-1369	27	6	conjugated	conjugate	VERB
ecletica-1369	27	7	organic	organic	ADJ
ecletica-1369	27	8	polymers	polymer	NOUN
ecletica-1369	27	9	(	(	PUNCT
ecletica-1369	27	10	jabha	jabha	PROPN
ecletica-1369	27	11	et	et	PROPN
ecletica-1369	27	12	al	al	PROPN
ecletica-1369	27	13	.	.	PROPN
ecletica-1369	27	14	,	,	PUNCT
ecletica-1369	27	15	2021	2021	NUM
ecletica-1369	27	16	)	)	PUNCT
ecletica-1369	27	17	have	have	VERB
ecletica-1369	27	18	the	the	DET
ecletica-1369	27	19	same	same	ADJ
ecletica-1369	27	20	mechanism	mechanism	NOUN
ecletica-1369	27	21	of	of	ADP
ecletica-1369	27	22	charge	charge	NOUN
ecletica-1369	27	23	transfer	transfer	NOUN
ecletica-1369	27	24	,	,	PUNCT
ecletica-1369	27	25	their	their	PRON
ecletica-1369	27	26	rate	rate	NOUN
ecletica-1369	27	27	of	of	ADP
ecletica-1369	27	28	hole	hole	NOUN
ecletica-1369	27	29	and	and	CCONJ
ecletica-1369	27	30	electron	electron	NOUN
ecletica-1369	27	31	transfer	transfer	NOUN
ecletica-1369	27	32	mainly	mainly	ADV
ecletica-1369	27	33	depends	depend	VERB
ecletica-1369	27	34	on	on	ADP
ecletica-1369	27	35	the	the	DET
ecletica-1369	27	36	reorganization	reorganization	NOUN
ecletica-1369	27	37	energy	energy	NOUN
ecletica-1369	27	38	due	due	ADP
ecletica-1369	27	39	to	to	ADP
ecletica-1369	27	40	the	the	DET
ecletica-1369	27	41	geometrical	geometrical	ADJ
ecletica-1369	27	42	relaxation	relaxation	NOUN
ecletica-1369	27	43	that	that	PRON
ecletica-1369	27	44	accompanies	accompany	VERB
ecletica-1369	27	45	this	this	DET
ecletica-1369	27	46	transfer	transfer	NOUN
ecletica-1369	27	47	(	(	PUNCT
ecletica-1369	27	48	andré	andré	NOUN
ecletica-1369	27	49	and	and	CCONJ
ecletica-1369	27	50	brédas	bréda	NOUN
ecletica-1369	27	51	,	,	PUNCT
ecletica-1369	27	52	2002	2002	NUM
ecletica-1369	27	53	)	)	PUNCT
ecletica-1369	27	54	.	.	PUNCT
ecletica-1369	28	1	the	the	DET
ecletica-1369	28	2	reorganization	reorganization	NOUN
ecletica-1369	28	3	energy	energy	NOUN
ecletica-1369	28	4	is	be	AUX
ecletica-1369	28	5	usually	usually	ADV
ecletica-1369	28	6	expressed	express	VERB
ecletica-1369	28	7	as	as	ADP
ecletica-1369	28	8	the	the	DET
ecletica-1369	28	9	sum	sum	NOUN
ecletica-1369	28	10	of	of	ADP
ecletica-1369	28	11	the	the	DET
ecletica-1369	28	12	internal	internal	ADJ
ecletica-1369	28	13	and	and	CCONJ
ecletica-1369	28	14	external	external	ADJ
ecletica-1369	28	15	contributions	contribution	NOUN
ecletica-1369	28	16	.	.	PUNCT
ecletica-1369	29	1	the	the	DET
ecletica-1369	29	2	internal	internal	ADJ
ecletica-1369	29	3	reorganization	reorganization	NOUN
ecletica-1369	29	4	energy	energy	NOUN
ecletica-1369	29	5	comes	come	VERB
ecletica-1369	29	6	from	from	ADP
ecletica-1369	29	7	the	the	DET
ecletica-1369	29	8	change	change	NOUN
ecletica-1369	29	9	in	in	ADP
ecletica-1369	29	10	the	the	DET
ecletica-1369	29	11	equilibrium	equilibrium	NOUN
ecletica-1369	29	12	geometry	geometry	NOUN
ecletica-1369	29	13	of	of	ADP
ecletica-1369	29	14	the	the	DET
ecletica-1369	29	15	donor	donor	NOUN
ecletica-1369	29	16	and	and	CCONJ
ecletica-1369	29	17	acceptor	acceptor	NOUN
ecletica-1369	29	18	sites	site	NOUN
ecletica-1369	29	19	due	due	ADJ
ecletica-1369	29	20	to	to	PART
ecletica-1369	29	21	charge	charge	VERB
ecletica-1369	29	22	gain	gain	NOUN
ecletica-1369	29	23	/	/	SYM
ecletica-1369	29	24	loss	loss	NOUN
ecletica-1369	29	25	during	during	ADP
ecletica-1369	29	26	an	an	DET
ecletica-1369	29	27	electron	electron	NOUN
ecletica-1369	29	28	transfer	transfer	NOUN
ecletica-1369	29	29	.	.	PUNCT
ecletica-1369	30	1	the	the	DET
ecletica-1369	30	2	external	external	ADJ
ecletica-1369	30	3	reorganization	reorganization	NOUN
ecletica-1369	30	4	energy	energy	NOUN
ecletica-1369	30	5	comes	come	VERB
ecletica-1369	30	6	from	from	ADP
ecletica-1369	30	7	the	the	DET
ecletica-1369	30	8	electronic	electronic	ADJ
ecletica-1369	30	9	and	and	CCONJ
ecletica-1369	30	10	nuclear	nuclear	ADJ
ecletica-1369	30	11	polarization	polarization	NOUN
ecletica-1369	30	12	/	/	SYM
ecletica-1369	30	13	decay	decay	NOUN
ecletica-1369	30	14	of	of	ADP
ecletica-1369	30	15	a	a	DET
ecletica-1369	30	16	surrounding	surround	VERB
ecletica-1369	30	17	medium	medium	NOUN
ecletica-1369	30	18	.	.	PUNCT
ecletica-1369	31	1	in	in	ADP
ecletica-1369	31	2	this	this	DET
ecletica-1369	31	3	manuscript	manuscript	NOUN
ecletica-1369	31	4	,	,	PUNCT
ecletica-1369	31	5	the	the	DET
ecletica-1369	31	6	strategy	strategy	NOUN
ecletica-1369	31	7	is	be	AUX
ecletica-1369	31	8	the	the	DET
ecletica-1369	31	9	theoretical	theoretical	ADJ
ecletica-1369	31	10	study	study	NOUN
ecletica-1369	31	11	of	of	ADP
ecletica-1369	31	12	the	the	DET
ecletica-1369	31	13	structural	structural	ADJ
ecletica-1369	31	14	properties	property	NOUN
ecletica-1369	31	15	of	of	ADP
ecletica-1369	31	16	a	a	DET
ecletica-1369	31	17	carbazole	carbazole	NOUN
ecletica-1369	31	18	-	-	PUNCT
ecletica-1369	31	19	based	base	VERB
ecletica-1369	31	20	oligomers	oligomer	NOUN
ecletica-1369	31	21	series	series	NOUN
ecletica-1369	31	22	,	,	PUNCT
ecletica-1369	31	23	in	in	ADP
ecletica-1369	31	24	order	order	NOUN
ecletica-1369	31	25	to	to	PART
ecletica-1369	31	26	reveal	reveal	VERB
ecletica-1369	31	27	the	the	DET
ecletica-1369	31	28	charge	charge	NOUN
ecletica-1369	31	29	transfer	transfer	NOUN
ecletica-1369	31	30	and	and	CCONJ
ecletica-1369	31	31	electronic	electronic	ADJ
ecletica-1369	31	32	properties	property	NOUN
ecletica-1369	31	33	of	of	ADP
ecletica-1369	31	34	organic	organic	ADJ
ecletica-1369	31	35	semiconductor	semiconductor	NOUN
ecletica-1369	31	36	materials	material	NOUN
ecletica-1369	31	37	of	of	ADP
ecletica-1369	31	38	different	different	ADJ
ecletica-1369	31	39	natures	nature	NOUN
ecletica-1369	31	40	.	.	PUNCT
ecletica-1369	32	1	the	the	DET
ecletica-1369	32	2	effect	effect	NOUN
ecletica-1369	32	3	of	of	ADP
ecletica-1369	32	4	substitution	substitution	NOUN
ecletica-1369	32	5	and	and	CCONJ
ecletica-1369	32	6	nature	nature	NOUN
ecletica-1369	32	7	of	of	ADP
ecletica-1369	32	8	substituent	substituent	NOUN
ecletica-1369	32	9	grouping	group	VERB
ecletica-1369	32	10	on	on	ADP
ecletica-1369	32	11	the	the	DET
ecletica-1369	32	12	reorganization	reorganization	NOUN
ecletica-1369	32	13	energy	energy	NOUN
ecletica-1369	32	14	for	for	ADP
ecletica-1369	32	15	hole	hole	NOUN
ecletica-1369	32	16	and	and	CCONJ
ecletica-1369	32	17	electron	electron	NOUN
ecletica-1369	32	18	transfer	transfer	NOUN
ecletica-1369	32	19	(	(	PUNCT
ecletica-1369	32	20	λ+	λ+	X
ecletica-1369	32	21	and	and	CCONJ
ecletica-1369	32	22	λ	λ	NOUN
ecletica-1369	32	23	–	–	PUNCT
ecletica-1369	32	24	)	)	PUNCT
ecletica-1369	32	25	and	and	CCONJ
ecletica-1369	32	26	electron	electron	NOUN
ecletica-1369	32	27	affinity	affinity	NOUN
ecletica-1369	32	28	and	and	CCONJ
ecletica-1369	32	29	ionization	ionization	NOUN
ecletica-1369	32	30	potential	potential	NOUN
ecletica-1369	32	31	are	be	AUX
ecletica-1369	32	32	also	also	ADV
ecletica-1369	32	33	investigated	investigate	VERB
ecletica-1369	32	34	(	(	PUNCT
ecletica-1369	32	35	schwenn	schwenn	PROPN
ecletica-1369	32	36	et	et	PROPN
ecletica-1369	32	37	al	al	PROPN
ecletica-1369	32	38	.	.	PROPN
ecletica-1369	32	39	,	,	PUNCT
ecletica-1369	32	40	2011	2011	NUM
ecletica-1369	32	41	)	)	PUNCT
ecletica-1369	32	42	.	.	PUNCT
ecletica-1369	33	1	2	2	X
ecletica-1369	33	2	.	.	X
ecletica-1369	33	3	computational	computational	ADJ
ecletica-1369	33	4	details	detail	NOUN
ecletica-1369	33	5	all	all	DET
ecletica-1369	33	6	calculations	calculation	NOUN
ecletica-1369	33	7	were	be	AUX
ecletica-1369	33	8	performed	perform	VERB
ecletica-1369	33	9	using	use	VERB
ecletica-1369	33	10	the	the	DET
ecletica-1369	33	11	gaussian	gaussian	ADJ
ecletica-1369	33	12	09	09	NUM
ecletica-1369	33	13	series	series	NOUN
ecletica-1369	33	14	(	(	PUNCT
ecletica-1369	33	15	bally	bally	PROPN
ecletica-1369	33	16	et	et	PROPN
ecletica-1369	33	17	al	al	PROPN
ecletica-1369	33	18	.	.	PROPN
ecletica-1369	33	19	,	,	PUNCT
ecletica-1369	33	20	1991	1991	NUM
ecletica-1369	33	21	;	;	PUNCT
ecletica-1369	33	22	frisch	frisch	VERB
ecletica-1369	33	23	et	et	PROPN
ecletica-1369	33	24	al	al	PROPN
ecletica-1369	33	25	.	.	PROPN
ecletica-1369	33	26	,	,	PUNCT
ecletica-1369	33	27	1984	1984	NUM
ecletica-1369	33	28	;	;	PUNCT
ecletica-1369	33	29	green	green	PROPN
ecletica-1369	33	30	et	et	PROPN
ecletica-1369	33	31	al	al	PROPN
ecletica-1369	33	32	.	.	PROPN
ecletica-1369	33	33	,	,	PUNCT
ecletica-1369	33	34	2005	2005	NUM
ecletica-1369	33	35	;	;	PUNCT
ecletica-1369	33	36	rassolov	rassolov	VERB
ecletica-1369	33	37	et	et	PROPN
ecletica-1369	33	38	al	al	PROPN
ecletica-1369	33	39	.	.	PROPN
ecletica-1369	33	40	,	,	PUNCT
ecletica-1369	33	41	2001	2001	NUM
ecletica-1369	33	42	)	)	PUNCT
ecletica-1369	33	43	.	.	PUNCT
ecletica-1369	34	1	the	the	DET
ecletica-1369	34	2	ground	ground	NOUN
ecletica-1369	34	3	state	state	NOUN
ecletica-1369	34	4	structure	structure	NOUN
ecletica-1369	34	5	of	of	ADP
ecletica-1369	34	6	all	all	DET
ecletica-1369	34	7	oligomers	oligomer	NOUN
ecletica-1369	34	8	was	be	AUX
ecletica-1369	34	9	fully	fully	ADV
ecletica-1369	34	10	optimized	optimize	VERB
ecletica-1369	34	11	at	at	ADP
ecletica-1369	34	12	the	the	DET
ecletica-1369	34	13	level	level	NOUN
ecletica-1369	34	14	of	of	ADP
ecletica-1369	34	15	dft	dft	PROPN
ecletica-1369	34	16	theory	theory	NOUN
ecletica-1369	34	17	and	and	CCONJ
ecletica-1369	34	18	b3lyp	b3lyp	NOUN
ecletica-1369	34	19	functional	functional	ADJ
ecletica-1369	34	20	by	by	ADP
ecletica-1369	34	21	choosing	choose	VERB
ecletica-1369	34	22	6	6	NUM
ecletica-1369	34	23	-	-	SYM
ecletica-1369	34	24	31	31	NUM
ecletica-1369	34	25	g	g	NOUN
ecletica-1369	34	26	(	(	PUNCT
ecletica-1369	34	27	d	d	PROPN
ecletica-1369	34	28	,	,	PUNCT
ecletica-1369	34	29	p	p	NOUN
ecletica-1369	34	30	)	)	PUNCT
ecletica-1369	34	31	basis	basis	NOUN
ecletica-1369	34	32	set	set	NOUN
ecletica-1369	34	33	(	(	PUNCT
ecletica-1369	34	34	baker	baker	PROPN
ecletica-1369	34	35	et	et	PROPN
ecletica-1369	34	36	al	al	PROPN
ecletica-1369	34	37	.	.	PROPN
ecletica-1369	34	38	,	,	PUNCT
ecletica-1369	34	39	1995	1995	NUM
ecletica-1369	34	40	;	;	PUNCT
ecletica-1369	34	41	ochterski	ochterski	NOUN
ecletica-1369	34	42	et	et	PROPN
ecletica-1369	34	43	al	al	PROPN
ecletica-1369	34	44	.	.	PROPN
ecletica-1369	34	45	,	,	PUNCT
ecletica-1369	34	46	1996	1996	NUM
ecletica-1369	34	47	;	;	PUNCT
ecletica-1369	34	48	petersson	petersson	NOUN
ecletica-1369	34	49	and	and	CCONJ
ecletica-1369	34	50	al‐laham	al‐laham	PROPN
ecletica-1369	34	51	,	,	PUNCT
ecletica-1369	34	52	1991	1991	NUM
ecletica-1369	34	53	)	)	PUNCT
ecletica-1369	34	54	.	.	PUNCT
ecletica-1369	35	1	the	the	DET
ecletica-1369	35	2	values	value	NOUN
ecletica-1369	35	3	of	of	ADP
ecletica-1369	35	4	highest	high	ADJ
ecletica-1369	35	5	occupied	occupy	VERB
ecletica-1369	35	6	molecular	molecular	ADJ
ecletica-1369	35	7	orbital	orbital	ADJ
ecletica-1369	35	8	(	(	PUNCT
ecletica-1369	35	9	homo	homo	NOUN
ecletica-1369	35	10	)	)	PUNCT
ecletica-1369	35	11	,	,	PUNCT
ecletica-1369	35	12	lowest	low	ADJ
ecletica-1369	35	13	unoccupied	unoccupied	ADJ
ecletica-1369	35	14	molecular	molecular	ADJ
ecletica-1369	35	15	orbital	orbital	ADJ
ecletica-1369	35	16	(	(	PUNCT
ecletica-1369	35	17	lumo	lumo	NOUN
ecletica-1369	35	18	)	)	PUNCT
ecletica-1369	35	19	,	,	PUNCT
ecletica-1369	35	20	eg	eg	NOUN
ecletica-1369	35	21	levels	level	NOUN
ecletica-1369	35	22	,	,	PUNCT
ecletica-1369	35	23	dihedral	dihedral	ADJ
ecletica-1369	35	24	angles	angle	NOUN
ecletica-1369	35	25	,	,	PUNCT
ecletica-1369	35	26	bond	bond	NOUN
ecletica-1369	35	27	lengths	length	NOUN
ecletica-1369	35	28	and	and	CCONJ
ecletica-1369	35	29	energies	energy	NOUN
ecletica-1369	35	30	of	of	ADP
ecletica-1369	35	31	the	the	DET
ecletica-1369	35	32	minima	minima	NOUN
ecletica-1369	35	33	of	of	ADP
ecletica-1369	35	34	the	the	DET
ecletica-1369	35	35	compounds	compound	NOUN
ecletica-1369	35	36	were	be	AUX
ecletica-1369	35	37	determined	determine	VERB
ecletica-1369	35	38	from	from	ADP
ecletica-1369	35	39	these	these	DET
ecletica-1369	35	40	optimized	optimize	VERB
ecletica-1369	35	41	geometries	geometry	NOUN
ecletica-1369	35	42	.	.	PUNCT
ecletica-1369	36	1	in	in	ADP
ecletica-1369	36	2	the	the	DET
ecletica-1369	36	3	same	same	ADJ
ecletica-1369	36	4	way	way	NOUN
ecletica-1369	36	5	the	the	DET
ecletica-1369	36	6	charge	charge	NOUN
ecletica-1369	36	7	quantities	quantity	NOUN
ecletica-1369	36	8	were	be	AUX
ecletica-1369	36	9	determined	determine	VERB
ecletica-1369	36	10	at	at	ADP
ecletica-1369	36	11	the	the	DET
ecletica-1369	36	12	same	same	ADJ
ecletica-1369	36	13	level	level	NOUN
ecletica-1369	36	14	and	and	CCONJ
ecletica-1369	36	15	on	on	ADP
ecletica-1369	36	16	the	the	DET
ecletica-1369	36	17	same	same	ADJ
ecletica-1369	36	18	optimized	optimize	VERB
ecletica-1369	36	19	structures	structure	NOUN
ecletica-1369	36	20	.	.	PUNCT
ecletica-1369	37	1	for	for	ADP
ecletica-1369	37	2	the	the	DET
ecletica-1369	37	3	ultraviolet	ultraviolet	NOUN
ecletica-1369	37	4	-	-	PUNCT
ecletica-1369	37	5	visible	visible	ADJ
ecletica-1369	37	6	(	(	PUNCT
ecletica-1369	37	7	uv	uv	NOUN
ecletica-1369	37	8	-	-	PUNCT
ecletica-1369	37	9	vis	vis	X
ecletica-1369	37	10	)	)	PUNCT
ecletica-1369	37	11	spectrum	spectrum	NOUN
ecletica-1369	37	12	as	as	ADV
ecletica-1369	37	13	well	well	ADV
ecletica-1369	37	14	as	as	ADP
ecletica-1369	37	15	the	the	DET
ecletica-1369	37	16	oscillator	oscillator	NOUN
ecletica-1369	37	17	power	power	NOUN
ecletica-1369	37	18	(	(	PUNCT
ecletica-1369	37	19	f	f	NOUN
ecletica-1369	37	20	)	)	PUNCT
ecletica-1369	37	21	,	,	PUNCT
ecletica-1369	37	22	excitation	excitation	NOUN
ecletica-1369	37	23	energies	energy	NOUN
ecletica-1369	37	24	and	and	CCONJ
ecletica-1369	37	25	wavelengths	wavelength	NOUN
ecletica-1369	37	26	of	of	ADP
ecletica-1369	37	27	the	the	DET
ecletica-1369	37	28	oligomers	oligomer	NOUN
ecletica-1369	37	29	,	,	PUNCT
ecletica-1369	37	30	has	have	AUX
ecletica-1369	37	31	been	be	AUX
ecletica-1369	37	32	chosen	choose	VERB
ecletica-1369	37	33	the	the	DET
ecletica-1369	37	34	tdbp86/6	tdbp86/6	NOUN
ecletica-1369	37	35	-	-	PUNCT
ecletica-1369	37	36	31	31	NUM
ecletica-1369	37	37	g	g	NOUN
ecletica-1369	37	38	(	(	PUNCT
ecletica-1369	37	39	d	d	PROPN
ecletica-1369	37	40	,	,	PUNCT
ecletica-1369	37	41	p	p	NOUN
ecletica-1369	37	42	)	)	PUNCT
ecletica-1369	37	43	method	method	NOUN
ecletica-1369	37	44	(	(	PUNCT
ecletica-1369	37	45	becke	becke	NOUN
ecletica-1369	37	46	et	et	PROPN
ecletica-1369	37	47	al	al	PROPN
ecletica-1369	37	48	.	.	PROPN
ecletica-1369	37	49	,	,	PUNCT
ecletica-1369	37	50	1988	1988	NUM
ecletica-1369	37	51	;	;	PUNCT
ecletica-1369	37	52	burke	burke	PROPN
ecletica-1369	37	53	et	et	PROPN
ecletica-1369	37	54	al	al	PROPN
ecletica-1369	37	55	.	.	PROPN
ecletica-1369	37	56	,	,	PUNCT
ecletica-1369	37	57	1996	1996	NUM
ecletica-1369	37	58	)	)	PUNCT
ecletica-1369	37	59	for	for	ADP
ecletica-1369	37	60	its	its	PRON
ecletica-1369	37	61	reliability	reliability	NOUN
ecletica-1369	37	62	in	in	ADP
ecletica-1369	37	63	such	such	ADJ
ecletica-1369	37	64	evaluations	evaluation	NOUN
ecletica-1369	37	65	.	.	PUNCT
ecletica-1369	38	1	3	3	X
ecletica-1369	38	2	.	.	NOUN
ecletica-1369	38	3	results	result	NOUN
ecletica-1369	38	4	and	and	CCONJ
ecletica-1369	38	5	discussion	discussion	NOUN
ecletica-1369	38	6	the	the	DET
ecletica-1369	38	7	9-(4	9-(4	NUM
ecletica-1369	38	8	-	-	PUNCT
ecletica-1369	38	9	octyloxyphenyl)-2.7	octyloxyphenyl)-2.7	NOUN
ecletica-1369	38	10	-	-	PUNCT
ecletica-1369	38	11	divinylcabazole	divinylcabazole	NOUN
ecletica-1369	38	12	(	(	PUNCT
ecletica-1369	38	13	crvh	crvh	NOUN
ecletica-1369	38	14	)	)	PUNCT
ecletica-1369	38	15	(	(	PUNCT
ecletica-1369	38	16	leclerc	leclerc	PROPN
ecletica-1369	38	17	et	et	PROPN
ecletica-1369	38	18	al	al	PROPN
ecletica-1369	38	19	.	.	PROPN
ecletica-1369	38	20	,	,	PUNCT
ecletica-1369	38	21	2006	2006	NUM
ecletica-1369	38	22	)	)	PUNCT
ecletica-1369	38	23	is	be	AUX
ecletica-1369	38	24	the	the	DET
ecletica-1369	38	25	basic	basic	ADJ
ecletica-1369	38	26	molecule	molecule	NOUN
ecletica-1369	38	27	,	,	PUNCT
ecletica-1369	38	28	(	(	PUNCT
ecletica-1369	38	29	fig	fig	NOUN
ecletica-1369	38	30	.	.	NOUN
ecletica-1369	38	31	1	1	NUM
ecletica-1369	38	32	)	)	PUNCT
ecletica-1369	38	33	,	,	PUNCT
ecletica-1369	38	34	in	in	ADP
ecletica-1369	38	35	which	which	PRON
ecletica-1369	38	36	we	we	PRON
ecletica-1369	38	37	substituted	substitute	VERB
ecletica-1369	38	38	the	the	DET
ecletica-1369	38	39	vinyl	vinyl	NOUN
ecletica-1369	38	40	hydrogen	hydrogen	NOUN
ecletica-1369	38	41	with	with	ADP
ecletica-1369	38	42	heterocyclic	heterocyclic	ADJ
ecletica-1369	38	43	groups	group	NOUN
ecletica-1369	38	44	(	(	PUNCT
ecletica-1369	38	45	r	r	NOUN
ecletica-1369	38	46	)	)	PUNCT
ecletica-1369	38	47	.	.	PUNCT
ecletica-1369	39	1	figure	figure	NOUN
ecletica-1369	39	2	2	2	NUM
ecletica-1369	39	3	presents	present	VERB
ecletica-1369	39	4	the	the	DET
ecletica-1369	39	5	different	different	ADJ
ecletica-1369	39	6	r	r	NOUN
ecletica-1369	39	7	groups	group	NOUN
ecletica-1369	39	8	studied	study	VERB
ecletica-1369	39	9	by	by	ADP
ecletica-1369	39	10	the	the	DET
ecletica-1369	39	11	dft	dft	PROPN
ecletica-1369	39	12	method	method	NOUN
ecletica-1369	39	13	to	to	PART
ecletica-1369	39	14	investigate	investigate	VERB
ecletica-1369	39	15	the	the	DET
ecletica-1369	39	16	substitution	substitution	NOUN
ecletica-1369	39	17	effects	effect	NOUN
ecletica-1369	39	18	on	on	ADP
ecletica-1369	39	19	the	the	DET
ecletica-1369	39	20	electronic	electronic	ADJ
ecletica-1369	39	21	and	and	CCONJ
ecletica-1369	39	22	optoelectronic	optoelectronic	ADJ
ecletica-1369	39	23	properties	property	NOUN
ecletica-1369	39	24	of	of	ADP
ecletica-1369	39	25	the	the	DET
ecletica-1369	39	26	crv	crv	NOUN
ecletica-1369	39	27	-	-	PUNCT
ecletica-1369	39	28	r	r	NOUN
ecletica-1369	39	29	system	system	NOUN
ecletica-1369	39	30	(	(	PUNCT
ecletica-1369	39	31	jabha	jabha	PROPN
ecletica-1369	39	32	et	et	PROPN
ecletica-1369	39	33	al	al	PROPN
ecletica-1369	39	34	.	.	PROPN
ecletica-1369	39	35	,	,	PUNCT
ecletica-1369	39	36	2022	2022	NUM
ecletica-1369	39	37	)	)	PUNCT
ecletica-1369	39	38	.	.	PUNCT
ecletica-1369	40	1	figure	figure	NOUN
ecletica-1369	40	2	1	1	NUM
ecletica-1369	40	3	.	.	PUNCT
ecletica-1369	41	1	structure	structure	NOUN
ecletica-1369	41	2	of	of	ADP
ecletica-1369	41	3	9-(4	9-(4	PROPN
ecletica-1369	41	4	-	-	PUNCT
ecletica-1369	41	5	octyloxyphenyl)-2,7divinylcabazole	octyloxyphenyl)-2,7divinylcabazole	NOUN
ecletica-1369	41	6	(	(	PUNCT
ecletica-1369	41	7	crv	crv	NOUN
ecletica-1369	41	8	-	-	PUNCT
ecletica-1369	41	9	h	h	NOUN
ecletica-1369	41	10	)	)	PUNCT
ecletica-1369	41	11	;	;	PUNCT
ecletica-1369	41	12	r	r	X
ecletica-1369	41	13	=	=	PROPN
ecletica-1369	41	14	h.	h.	PROPN
ecletica-1369	41	15	source	source	NOUN
ecletica-1369	41	16	:	:	PUNCT
ecletica-1369	41	17	adapted	adapt	VERB
ecletica-1369	41	18	from	from	ADP
ecletica-1369	41	19	jabha	jabha	PROPN
ecletica-1369	41	20	et	et	PROPN
ecletica-1369	41	21	al	al	PROPN
ecletica-1369	41	22	.	.	PROPN
ecletica-1369	42	1	(	(	PUNCT
ecletica-1369	42	2	2022	2022	NUM
ecletica-1369	42	3	)	)	PUNCT
ecletica-1369	42	4	.	.	PUNCT
ecletica-1369	43	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	43	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	VERB
ecletica-1369	43	3	original	original	ADJ
ecletica-1369	43	4	article	article	NOUN
ecletica-1369	43	5	revista.iq.unesp.br	revista.iq.unesp.br	PUNCT
ecletica-1369	43	6	57	57	NUM
ecletica-1369	43	7	eclética	eclética	PROPN
ecletica-1369	43	8	química	química	PROPN
ecletica-1369	43	9	journal	journal	PROPN
ecletica-1369	43	10	,	,	PUNCT
ecletica-1369	43	11	vol	vol	NOUN
ecletica-1369	43	12	.	.	PROPN
ecletica-1369	43	13	47	47	NUM
ecletica-1369	43	14	,	,	PUNCT
ecletica-1369	43	15	n.	n.	NOUN
ecletica-1369	43	16	4	4	NUM
ecletica-1369	43	17	,	,	PUNCT
ecletica-1369	43	18	2022	2022	NUM
ecletica-1369	43	19	,	,	PUNCT
ecletica-1369	43	20	55	55	NUM
ecletica-1369	43	21	-	-	SYM
ecletica-1369	43	22	68	68	NUM
ecletica-1369	43	23	issn	issn	NOUN
ecletica-1369	43	24	:	:	PUNCT
ecletica-1369	43	25	1678	1678	NUM
ecletica-1369	43	26	-	-	SYM
ecletica-1369	43	27	4618	4618	NUM
ecletica-1369	43	28	doi	doi	NOUN
ecletica-1369	43	29	:	:	PUNCT
ecletica-1369	43	30	10.26850/1678	10.26850/1678	NUM
ecletica-1369	43	31	-	-	SYM
ecletica-1369	43	32	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	43	33	-	-	PUNCT
ecletica-1369	43	34	68	68	NUM
ecletica-1369	43	35	figure	figure	NOUN
ecletica-1369	43	36	2	2	NUM
ecletica-1369	43	37	.	.	NOUN
ecletica-1369	43	38	schema	schema	NOUN
ecletica-1369	43	39	and	and	CCONJ
ecletica-1369	43	40	symbol	symbol	NOUN
ecletica-1369	43	41	of	of	ADP
ecletica-1369	43	42	r	r	NOUN
ecletica-1369	43	43	groups	group	NOUN
ecletica-1369	43	44	.	.	PUNCT
ecletica-1369	44	1	source	source	NOUN
ecletica-1369	44	2	:	:	PUNCT
ecletica-1369	44	3	adapted	adapt	VERB
ecletica-1369	44	4	from	from	ADP
ecletica-1369	44	5	jabha	jabha	PROPN
ecletica-1369	44	6	et	et	PROPN
ecletica-1369	44	7	al	al	PROPN
ecletica-1369	44	8	.	.	PROPN
ecletica-1369	44	9	(	(	PUNCT
ecletica-1369	44	10	2022	2022	NUM
ecletica-1369	44	11	)	)	PUNCT
ecletica-1369	44	12	.	.	PUNCT
ecletica-1369	45	1	3.1	3.1	NUM
ecletica-1369	45	2	structural	structural	ADJ
ecletica-1369	45	3	properties	property	NOUN
ecletica-1369	45	4	all	all	DET
ecletica-1369	45	5	oligomers	oligomer	NOUN
ecletica-1369	45	6	were	be	AUX
ecletica-1369	45	7	optimized	optimize	VERB
ecletica-1369	45	8	at	at	ADP
ecletica-1369	45	9	the	the	DET
ecletica-1369	45	10	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	45	11	-	-	PROPN
ecletica-1369	45	12	31	31	NUM
ecletica-1369	45	13	g	g	NOUN
ecletica-1369	45	14	(	(	PUNCT
ecletica-1369	45	15	d	d	PROPN
ecletica-1369	45	16	,	,	PUNCT
ecletica-1369	45	17	p	p	NOUN
ecletica-1369	45	18	)	)	PUNCT
ecletica-1369	45	19	level	level	NOUN
ecletica-1369	45	20	,	,	PUNCT
ecletica-1369	45	21	and	and	CCONJ
ecletica-1369	45	22	fig	fig	NOUN
ecletica-1369	45	23	.	.	PUNCT
ecletica-1369	46	1	3	3	NUM
ecletica-1369	46	2	represents	represent	VERB
ecletica-1369	46	3	the	the	DET
ecletica-1369	46	4	most	most	ADV
ecletica-1369	46	5	stable	stable	ADJ
ecletica-1369	46	6	conformations	conformation	NOUN
ecletica-1369	46	7	.	.	PUNCT
ecletica-1369	47	1	for	for	ADP
ecletica-1369	47	2	a	a	DET
ecletica-1369	47	3	credible	credible	ADJ
ecletica-1369	47	4	study	study	NOUN
ecletica-1369	47	5	of	of	ADP
ecletica-1369	47	6	the	the	DET
ecletica-1369	47	7	structural	structural	ADJ
ecletica-1369	47	8	properties	property	NOUN
ecletica-1369	47	9	,	,	PUNCT
ecletica-1369	47	10	extractions	extraction	NOUN
ecletica-1369	47	11	of	of	ADP
ecletica-1369	47	12	the	the	DET
ecletica-1369	47	13	main	main	ADJ
ecletica-1369	47	14	structural	structural	ADJ
ecletica-1369	47	15	parameters	parameter	NOUN
ecletica-1369	47	16	are	be	AUX
ecletica-1369	47	17	necessary	necessary	ADJ
ecletica-1369	47	18	.	.	PUNCT
ecletica-1369	48	1	based	base	VERB
ecletica-1369	48	2	on	on	ADP
ecletica-1369	48	3	the	the	DET
ecletica-1369	48	4	optimization	optimization	NOUN
ecletica-1369	48	5	of	of	ADP
ecletica-1369	48	6	the	the	DET
ecletica-1369	48	7	systems	system	NOUN
ecletica-1369	48	8	by	by	ADP
ecletica-1369	48	9	the	the	DET
ecletica-1369	48	10	dft	dft	PROPN
ecletica-1369	48	11	method	method	NOUN
ecletica-1369	48	12	at	at	ADP
ecletica-1369	48	13	the	the	DET
ecletica-1369	48	14	level	level	NOUN
ecletica-1369	48	15	of	of	ADP
ecletica-1369	48	16	the	the	DET
ecletica-1369	48	17	b3lyp	b3lyp	NOUN
ecletica-1369	48	18	functional	functional	ADJ
ecletica-1369	48	19	under	under	ADP
ecletica-1369	48	20	the	the	DET
ecletica-1369	48	21	atomic	atomic	ADJ
ecletica-1369	48	22	basis	basis	NOUN
ecletica-1369	48	23	6	6	NUM
ecletica-1369	48	24	-	-	SYM
ecletica-1369	48	25	31	31	NUM
ecletica-1369	48	26	g	g	NOUN
ecletica-1369	48	27	(	(	PUNCT
ecletica-1369	48	28	d	d	PROPN
ecletica-1369	48	29	,	,	PUNCT
ecletica-1369	48	30	p	p	NOUN
ecletica-1369	48	31	)	)	PUNCT
ecletica-1369	48	32	,	,	PUNCT
ecletica-1369	48	33	the	the	DET
ecletica-1369	48	34	geometrical	geometrical	ADJ
ecletica-1369	48	35	study	study	NOUN
ecletica-1369	48	36	of	of	ADP
ecletica-1369	48	37	the	the	DET
ecletica-1369	48	38	oligomers	oligomer	NOUN
ecletica-1369	48	39	neutral	neutral	ADJ
ecletica-1369	48	40	and	and	CCONJ
ecletica-1369	48	41	charged	charge	VERB
ecletica-1369	48	42	is	be	AUX
ecletica-1369	48	43	completed	complete	VERB
ecletica-1369	48	44	by	by	ADP
ecletica-1369	48	45	the	the	DET
ecletica-1369	48	46	calculation	calculation	NOUN
ecletica-1369	48	47	of	of	ADP
ecletica-1369	48	48	the	the	DET
ecletica-1369	48	49	various	various	ADJ
ecletica-1369	48	50	structural	structural	ADJ
ecletica-1369	48	51	parameters	parameter	NOUN
ecletica-1369	48	52	which	which	PRON
ecletica-1369	48	53	depend	depend	VERB
ecletica-1369	48	54	on	on	ADP
ecletica-1369	48	55	the	the	DET
ecletica-1369	48	56	geometry	geometry	NOUN
ecletica-1369	48	57	of	of	ADP
ecletica-1369	48	58	the	the	DET
ecletica-1369	48	59	molecules	molecule	NOUN
ecletica-1369	48	60	,	,	PUNCT
ecletica-1369	48	61	mainly	mainly	ADV
ecletica-1369	48	62	the	the	DET
ecletica-1369	48	63	dihedral	dihedral	ADJ
ecletica-1369	48	64	angles	angle	NOUN
ecletica-1369	48	65	,	,	PUNCT
ecletica-1369	48	66	the	the	DET
ecletica-1369	48	67	lengths	length	NOUN
ecletica-1369	48	68	of	of	ADP
ecletica-1369	48	69	the	the	DET
ecletica-1369	48	70	primordial	primordial	ADJ
ecletica-1369	48	71	bonds	bond	NOUN
ecletica-1369	48	72	between	between	ADP
ecletica-1369	48	73	the	the	DET
ecletica-1369	48	74	base	base	NOUN
ecletica-1369	48	75	unit	unit	NOUN
ecletica-1369	48	76	note	note	VERB
ecletica-1369	48	77	crv	crv	PROPN
ecletica-1369	48	78	and	and	CCONJ
ecletica-1369	48	79	the	the	DET
ecletica-1369	48	80	adjacent	adjacent	ADJ
ecletica-1369	48	81	groups	group	NOUN
ecletica-1369	48	82	r	r	X
ecletica-1369	48	83	(	(	PUNCT
ecletica-1369	48	84	fig	fig	NOUN
ecletica-1369	48	85	.	.	PUNCT
ecletica-1369	49	1	4	4	NUM
ecletica-1369	49	2	)	)	PUNCT
ecletica-1369	49	3	.	.	PUNCT
ecletica-1369	50	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	50	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	VERB
ecletica-1369	50	3	original	original	ADJ
ecletica-1369	50	4	article	article	NOUN
ecletica-1369	50	5	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1369	50	6	58	58	NUM
ecletica-1369	50	7	eclética	eclética	PROPN
ecletica-1369	50	8	química	química	PROPN
ecletica-1369	50	9	journal	journal	PROPN
ecletica-1369	50	10	,	,	PUNCT
ecletica-1369	50	11	vol	vol	NOUN
ecletica-1369	50	12	.	.	PROPN
ecletica-1369	50	13	47	47	NUM
ecletica-1369	50	14	,	,	PUNCT
ecletica-1369	50	15	n.	n.	NOUN
ecletica-1369	50	16	4	4	NUM
ecletica-1369	50	17	,	,	PUNCT
ecletica-1369	50	18	2022	2022	NUM
ecletica-1369	50	19	,	,	PUNCT
ecletica-1369	50	20	55	55	NUM
ecletica-1369	50	21	-	-	SYM
ecletica-1369	50	22	68	68	NUM
ecletica-1369	50	23	issn	issn	NOUN
ecletica-1369	50	24	:	:	PUNCT
ecletica-1369	50	25	1678	1678	NUM
ecletica-1369	50	26	-	-	SYM
ecletica-1369	50	27	4618	4618	NUM
ecletica-1369	50	28	doi	doi	NOUN
ecletica-1369	50	29	:	:	PUNCT
ecletica-1369	50	30	10.26850/1678	10.26850/1678	NUM
ecletica-1369	50	31	-	-	SYM
ecletica-1369	50	32	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	50	33	-	-	PUNCT
ecletica-1369	50	34	68	68	NUM
ecletica-1369	50	35	figure	figure	NOUN
ecletica-1369	50	36	3	3	NUM
ecletica-1369	50	37	.	.	PUNCT
ecletica-1369	51	1	different	different	ADJ
ecletica-1369	51	2	structures	structure	NOUN
ecletica-1369	51	3	optimized	optimize	VERB
ecletica-1369	51	4	by	by	ADP
ecletica-1369	51	5	the	the	DET
ecletica-1369	51	6	b3lyp/6	b3lyp/6	PROPN
ecletica-1369	51	7	-	-	NOUN
ecletica-1369	51	8	31g(d	31g(d	PROPN
ecletica-1369	51	9	,	,	PUNCT
ecletica-1369	51	10	p	p	NOUN
ecletica-1369	51	11	)	)	PUNCT
ecletica-1369	51	12	method	method	NOUN
ecletica-1369	51	13	.	.	PUNCT
ecletica-1369	52	1	(	(	PUNCT
ecletica-1369	52	2	a	a	X
ecletica-1369	52	3	)	)	PUNCT
ecletica-1369	52	4	crv	crv	PROPN
ecletica-1369	52	5	-	-	PUNCT
ecletica-1369	52	6	t	t	PROPN
ecletica-1369	52	7	;	;	PUNCT
ecletica-1369	52	8	(	(	PUNCT
ecletica-1369	52	9	b	b	X
ecletica-1369	52	10	)	)	PUNCT
ecletica-1369	52	11	crv	crv	PROPN
ecletica-1369	52	12	-	-	PUNCT
ecletica-1369	52	13	pt	pt	NOUN
ecletica-1369	52	14	;	;	PUNCT
ecletica-1369	52	15	(	(	PUNCT
ecletica-1369	52	16	c	c	X
ecletica-1369	52	17	)	)	PUNCT
ecletica-1369	52	18	crv	crv	PROPN
ecletica-1369	52	19	-	-	PUNCT
ecletica-1369	52	20	pp	pp	PROPN
ecletica-1369	52	21	;	;	PUNCT
ecletica-1369	52	22	(	(	PUNCT
ecletica-1369	52	23	d	d	X
ecletica-1369	52	24	)	)	PUNCT
ecletica-1369	52	25	crv	crv	PROPN
ecletica-1369	52	26	-	-	PUNCT
ecletica-1369	52	27	ttn	ttn	PROPN
ecletica-1369	52	28	;	;	PUNCT
ecletica-1369	52	29	(	(	PUNCT
ecletica-1369	52	30	e	e	X
ecletica-1369	52	31	)	)	PUNCT
ecletica-1369	52	32	crv	crv	PROPN
ecletica-1369	52	33	-	-	PUNCT
ecletica-1369	52	34	h	h	NOUN
ecletica-1369	52	35	;	;	PUNCT
ecletica-1369	52	36	(	(	PUNCT
ecletica-1369	52	37	f	f	X
ecletica-1369	52	38	)	)	PUNCT
ecletica-1369	52	39	crv	crv	PROPN
ecletica-1369	52	40	-	-	PUNCT
ecletica-1369	52	41	bbt	bbt	PROPN
ecletica-1369	52	42	.	.	PROPN
ecletica-1369	52	43	source	source	PROPN
ecletica-1369	52	44	:	:	PUNCT
ecletica-1369	52	45	adapted	adapt	VERB
ecletica-1369	52	46	from	from	ADP
ecletica-1369	52	47	jabha	jabha	PROPN
ecletica-1369	52	48	et	et	PROPN
ecletica-1369	52	49	al	al	PROPN
ecletica-1369	52	50	.	.	PROPN
ecletica-1369	52	51	(	(	PUNCT
ecletica-1369	52	52	2022	2022	NUM
ecletica-1369	52	53	)	)	PUNCT
ecletica-1369	52	54	.	.	PUNCT
ecletica-1369	53	1	figure	figure	VERB
ecletica-1369	53	2	4	4	NUM
ecletica-1369	53	3	.	.	PUNCT
ecletica-1369	54	1	position	position	NOUN
ecletica-1369	54	2	of	of	ADP
ecletica-1369	54	3	the	the	DET
ecletica-1369	54	4	dihedral	dihedral	ADJ
ecletica-1369	54	5	angles	angle	NOUN
ecletica-1369	54	6	,	,	PUNCT
ecletica-1369	54	7	and	and	CCONJ
ecletica-1369	54	8	the	the	DET
ecletica-1369	54	9	studied	study	VERB
ecletica-1369	54	10	bonds	bond	NOUN
ecletica-1369	54	11	.	.	PUNCT
ecletica-1369	55	1	source	source	NOUN
ecletica-1369	55	2	:	:	PUNCT
ecletica-1369	55	3	adapted	adapt	VERB
ecletica-1369	55	4	from	from	ADP
ecletica-1369	55	5	jabha	jabha	PROPN
ecletica-1369	55	6	et	et	PROPN
ecletica-1369	55	7	al	al	PROPN
ecletica-1369	55	8	.	.	PROPN
ecletica-1369	55	9	(	(	PUNCT
ecletica-1369	55	10	2022	2022	NUM
ecletica-1369	55	11	)	)	PUNCT
ecletica-1369	55	12	.	.	PUNCT
ecletica-1369	56	1	in	in	ADP
ecletica-1369	56	2	the	the	DET
ecletica-1369	56	3	theory	theory	NOUN
ecletica-1369	56	4	of	of	ADP
ecletica-1369	56	5	marcus	marcus	PROPN
ecletica-1369	56	6	et	et	PROPN
ecletica-1369	56	7	al	al	PROPN
ecletica-1369	56	8	.	.	PROPN
ecletica-1369	57	1	(	(	PUNCT
ecletica-1369	57	2	1989	1989	NUM
ecletica-1369	57	3	)	)	PUNCT
ecletica-1369	58	1	,	,	PUNCT
ecletica-1369	58	2	the	the	DET
ecletica-1369	58	3	charge	charge	NOUN
ecletica-1369	58	4	transfer	transfer	NOUN
ecletica-1369	58	5	integral	integral	ADJ
ecletica-1369	58	6	is	be	AUX
ecletica-1369	58	7	important	important	ADJ
ecletica-1369	58	8	for	for	ADP
ecletica-1369	58	9	electron	electron	NOUN
ecletica-1369	58	10	transfer	transfer	NOUN
ecletica-1369	58	11	because	because	SCONJ
ecletica-1369	58	12	it	it	PRON
ecletica-1369	58	13	is	be	AUX
ecletica-1369	58	14	one	one	NUM
ecletica-1369	58	15	of	of	ADP
ecletica-1369	58	16	the	the	DET
ecletica-1369	58	17	factors	factor	NOUN
ecletica-1369	58	18	for	for	ADP
ecletica-1369	58	19	calculating	calculate	VERB
ecletica-1369	58	20	the	the	DET
ecletica-1369	58	21	mobility	mobility	NOUN
ecletica-1369	58	22	of	of	ADP
ecletica-1369	58	23	a	a	DET
ecletica-1369	58	24	material	material	NOUN
ecletica-1369	58	25	.	.	PUNCT
ecletica-1369	59	1	the	the	DET
ecletica-1369	59	2	other	other	ADJ
ecletica-1369	59	3	factor	factor	NOUN
ecletica-1369	59	4	is	be	AUX
ecletica-1369	59	5	the	the	DET
ecletica-1369	59	6	reorganization	reorganization	NOUN
ecletica-1369	59	7	energy	energy	NOUN
ecletica-1369	59	8	.	.	PUNCT
ecletica-1369	60	1	the	the	PRON
ecletica-1369	60	2	higher	high	ADJ
ecletica-1369	60	3	the	the	DET
ecletica-1369	60	4	charge	charge	NOUN
ecletica-1369	60	5	transfer	transfer	NOUN
ecletica-1369	60	6	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	60	7	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	NOUN
ecletica-1369	60	8	original	original	ADJ
ecletica-1369	60	9	article	article	NOUN
ecletica-1369	60	10	revista.iq.unesp.br	revista.iq.unesp.br	PUNCT
ecletica-1369	60	11	59	59	NUM
ecletica-1369	60	12	eclética	eclética	PROPN
ecletica-1369	60	13	química	química	PROPN
ecletica-1369	60	14	journal	journal	PROPN
ecletica-1369	60	15	,	,	PUNCT
ecletica-1369	60	16	vol	vol	NOUN
ecletica-1369	60	17	.	.	PROPN
ecletica-1369	60	18	47	47	NUM
ecletica-1369	60	19	,	,	PUNCT
ecletica-1369	60	20	n.	n.	NOUN
ecletica-1369	60	21	4	4	NUM
ecletica-1369	60	22	,	,	PUNCT
ecletica-1369	60	23	2022	2022	NUM
ecletica-1369	60	24	,	,	PUNCT
ecletica-1369	60	25	55	55	NUM
ecletica-1369	60	26	-	-	SYM
ecletica-1369	60	27	68	68	NUM
ecletica-1369	60	28	issn	issn	NOUN
ecletica-1369	60	29	:	:	PUNCT
ecletica-1369	60	30	1678	1678	NUM
ecletica-1369	60	31	-	-	SYM
ecletica-1369	60	32	4618	4618	NUM
ecletica-1369	60	33	doi	doi	NOUN
ecletica-1369	60	34	:	:	PUNCT
ecletica-1369	60	35	10.26850/1678	10.26850/1678	NUM
ecletica-1369	60	36	-	-	SYM
ecletica-1369	60	37	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	60	38	-	-	PUNCT
ecletica-1369	60	39	68	68	NUM
ecletica-1369	60	40	integral	integral	ADJ
ecletica-1369	60	41	and	and	CCONJ
ecletica-1369	60	42	the	the	PRON
ecletica-1369	60	43	lower	low	ADJ
ecletica-1369	60	44	the	the	DET
ecletica-1369	60	45	reorganization	reorganization	NOUN
ecletica-1369	60	46	energy	energy	NOUN
ecletica-1369	60	47	,	,	PUNCT
ecletica-1369	60	48	the	the	PRON
ecletica-1369	60	49	higher	high	ADJ
ecletica-1369	60	50	the	the	DET
ecletica-1369	60	51	charge	charge	NOUN
ecletica-1369	60	52	transfer	transfer	NOUN
ecletica-1369	60	53	rate	rate	NOUN
ecletica-1369	60	54	and	and	CCONJ
ecletica-1369	60	55	mobility	mobility	NOUN
ecletica-1369	60	56	.	.	PUNCT
ecletica-1369	61	1	the	the	DET
ecletica-1369	61	2	charge	charge	NOUN
ecletica-1369	61	3	transfer	transfer	NOUN
ecletica-1369	61	4	integral	integral	ADJ
ecletica-1369	61	5	represents	represent	VERB
ecletica-1369	61	6	for	for	ADP
ecletica-1369	61	7	exchange	exchange	NOUN
ecletica-1369	61	8	electrons	electron	NOUN
ecletica-1369	61	9	between	between	ADP
ecletica-1369	61	10	molecules	molecule	NOUN
ecletica-1369	61	11	,	,	PUNCT
ecletica-1369	61	12	and	and	CCONJ
ecletica-1369	61	13	strongly	strongly	ADV
ecletica-1369	61	14	affected	affect	VERB
ecletica-1369	61	15	by	by	ADP
ecletica-1369	61	16	the	the	DET
ecletica-1369	61	17	intermolecular	intermolecular	ADJ
ecletica-1369	61	18	and/or	and/or	CCONJ
ecletica-1369	61	19	intramolecular	intramolecular	ADJ
ecletica-1369	61	20	(	(	PUNCT
ecletica-1369	61	21	interatomic	interatomic	ADJ
ecletica-1369	61	22	)	)	PUNCT
ecletica-1369	61	23	distance	distance	NOUN
ecletica-1369	61	24	,	,	PUNCT
ecletica-1369	61	25	the	the	PRON
ecletica-1369	61	26	shorter	short	ADJ
ecletica-1369	61	27	the	the	DET
ecletica-1369	61	28	distance	distance	NOUN
ecletica-1369	61	29	,	,	PUNCT
ecletica-1369	61	30	the	the	PRON
ecletica-1369	61	31	stronger	strong	ADJ
ecletica-1369	61	32	the	the	DET
ecletica-1369	61	33	orbital	orbital	ADJ
ecletica-1369	61	34	overlaps	overlap	NOUN
ecletica-1369	61	35	.	.	PUNCT
ecletica-1369	62	1	figures	figure	NOUN
ecletica-1369	62	2	5	5	NUM
ecletica-1369	62	3	and	and	CCONJ
ecletica-1369	62	4	6	6	NUM
ecletica-1369	62	5	illustrate	illustrate	VERB
ecletica-1369	62	6	the	the	DET
ecletica-1369	62	7	main	main	ADJ
ecletica-1369	62	8	structural	structural	ADJ
ecletica-1369	62	9	parameters	parameter	NOUN
ecletica-1369	62	10	,	,	PUNCT
ecletica-1369	62	11	especially	especially	ADV
ecletica-1369	62	12	the	the	DET
ecletica-1369	62	13	intramolecular	intramolecular	ADJ
ecletica-1369	62	14	distances	distance	NOUN
ecletica-1369	62	15	and	and	CCONJ
ecletica-1369	62	16	the	the	DET
ecletica-1369	62	17	dihedral	dihedral	ADJ
ecletica-1369	62	18	angles	angle	NOUN
ecletica-1369	62	19	of	of	ADP
ecletica-1369	62	20	the	the	DET
ecletica-1369	62	21	studied	study	VERB
ecletica-1369	62	22	systems	system	NOUN
ecletica-1369	62	23	.	.	PUNCT
ecletica-1369	63	1	figure	figure	NOUN
ecletica-1369	63	2	5	5	NUM
ecletica-1369	63	3	.	.	PUNCT
ecletica-1369	63	4	inter	inter	ADJ
ecletica-1369	63	5	-	-	ADJ
ecletica-1369	63	6	cyclic	cyclic	ADJ
ecletica-1369	63	7	lengths	length	NOUN
ecletica-1369	63	8	(	(	PUNCT
ecletica-1369	63	9	å	å	NOUN
ecletica-1369	63	10	)	)	PUNCT
ecletica-1369	63	11	obtained	obtain	VERB
ecletica-1369	63	12	by	by	ADP
ecletica-1369	63	13	the	the	DET
ecletica-1369	63	14	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	63	15	-	-	PUNCT
ecletica-1369	63	16	31	31	NUM
ecletica-1369	63	17	g	g	NOUN
ecletica-1369	63	18	method	method	NOUN
ecletica-1369	63	19	(	(	PUNCT
ecletica-1369	63	20	d	d	NOUN
ecletica-1369	63	21	,	,	PUNCT
ecletica-1369	63	22	p	p	NOUN
ecletica-1369	63	23	)	)	PUNCT
ecletica-1369	63	24	.	.	PUNCT
ecletica-1369	64	1	figure	figure	VERB
ecletica-1369	64	2	6	6	NUM
ecletica-1369	64	3	.	.	PUNCT
ecletica-1369	65	1	dihedral	dihedral	ADJ
ecletica-1369	65	2	angles	angle	NOUN
ecletica-1369	65	3	obtained	obtain	VERB
ecletica-1369	65	4	by	by	ADP
ecletica-1369	65	5	the	the	DET
ecletica-1369	65	6	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	65	7	-	-	PUNCT
ecletica-1369	65	8	31	31	NUM
ecletica-1369	65	9	g	g	NOUN
ecletica-1369	65	10	method	method	NOUN
ecletica-1369	65	11	(	(	PUNCT
ecletica-1369	65	12	d	d	NOUN
ecletica-1369	65	13	,	,	PUNCT
ecletica-1369	65	14	p	p	NOUN
ecletica-1369	65	15	)	)	PUNCT
ecletica-1369	65	16	.	.	PUNCT
ecletica-1369	66	1	the	the	DET
ecletica-1369	66	2	dihedral	dihedral	ADJ
ecletica-1369	66	3	angles	angle	NOUN
ecletica-1369	66	4	between	between	ADP
ecletica-1369	66	5	the	the	DET
ecletica-1369	66	6	blocks	block	NOUN
ecletica-1369	66	7	of	of	ADP
ecletica-1369	66	8	conjugated	conjugate	VERB
ecletica-1369	66	9	oligomers	oligomer	NOUN
ecletica-1369	66	10	contribute	contribute	VERB
ecletica-1369	66	11	significantly	significantly	ADV
ecletica-1369	66	12	to	to	ADP
ecletica-1369	66	13	the	the	DET
ecletica-1369	66	14	determination	determination	NOUN
ecletica-1369	66	15	of	of	ADP
ecletica-1369	66	16	the	the	DET
ecletica-1369	66	17	reorganization	reorganization	NOUN
ecletica-1369	66	18	energy	energy	NOUN
ecletica-1369	66	19	(	(	PUNCT
ecletica-1369	66	20	λtot	λtot	NOUN
ecletica-1369	66	21	)	)	PUNCT
ecletica-1369	66	22	and	and	CCONJ
ecletica-1369	66	23	the	the	DET
ecletica-1369	66	24	charge	charge	NOUN
ecletica-1369	66	25	transport	transport	NOUN
ecletica-1369	66	26	process	process	NOUN
ecletica-1369	66	27	.	.	PUNCT
ecletica-1369	67	1	thus	thus	ADV
ecletica-1369	67	2	,	,	PUNCT
ecletica-1369	67	3	comparison	comparison	NOUN
ecletica-1369	67	4	of	of	ADP
ecletica-1369	67	5	the	the	DET
ecletica-1369	67	6	dihedral	dihedral	ADJ
ecletica-1369	67	7	angles	angle	NOUN
ecletica-1369	67	8	between	between	ADP
ecletica-1369	67	9	charged	charge	VERB
ecletica-1369	67	10	and	and	CCONJ
ecletica-1369	67	11	neutral	neutral	ADJ
ecletica-1369	67	12	counterparts	counterpart	NOUN
ecletica-1369	67	13	is	be	AUX
ecletica-1369	67	14	crucial	crucial	ADJ
ecletica-1369	67	15	in	in	ADP
ecletica-1369	67	16	the	the	DET
ecletica-1369	67	17	optoelectronic	optoelectronic	ADJ
ecletica-1369	67	18	study	study	NOUN
ecletica-1369	67	19	of	of	ADP
ecletica-1369	67	20	these	these	DET
ecletica-1369	67	21	oligomers	oligomer	NOUN
ecletica-1369	67	22	.	.	PUNCT
ecletica-1369	68	1	the	the	DET
ecletica-1369	68	2	values	value	NOUN
ecletica-1369	68	3	of	of	ADP
ecletica-1369	68	4	the	the	DET
ecletica-1369	68	5	dihedral	dihedral	ADJ
ecletica-1369	68	6	angles	angle	NOUN
ecletica-1369	68	7	of	of	ADP
ecletica-1369	68	8	the	the	DET
ecletica-1369	68	9	neutral	neutral	ADJ
ecletica-1369	68	10	and	and	CCONJ
ecletica-1369	68	11	charged	charge	VERB
ecletica-1369	68	12	forms	form	NOUN
ecletica-1369	68	13	of	of	ADP
ecletica-1369	68	14	all	all	DET
ecletica-1369	68	15	the	the	DET
ecletica-1369	68	16	studied	studied	ADJ
ecletica-1369	68	17	oligomers	oligomer	NOUN
ecletica-1369	68	18	(	(	PUNCT
ecletica-1369	68	19	fig	fig	NOUN
ecletica-1369	68	20	.	.	NOUN
ecletica-1369	68	21	6	6	NUM
ecletica-1369	68	22	)	)	PUNCT
ecletica-1369	68	23	are	be	AUX
ecletica-1369	68	24	generally	generally	ADV
ecletica-1369	68	25	close	close	ADJ
ecletica-1369	68	26	to	to	ADP
ecletica-1369	68	27	180	180	NUM
ecletica-1369	68	28	°	°	NOUN
ecletica-1369	68	29	,	,	PUNCT
ecletica-1369	68	30	which	which	PRON
ecletica-1369	68	31	would	would	AUX
ecletica-1369	68	32	allow	allow	VERB
ecletica-1369	68	33	to	to	PART
ecletica-1369	68	34	conclude	conclude	VERB
ecletica-1369	68	35	that	that	SCONJ
ecletica-1369	68	36	the	the	DET
ecletica-1369	68	37	structures	structure	NOUN
ecletica-1369	68	38	are	be	AUX
ecletica-1369	68	39	nearly	nearly	ADV
ecletica-1369	68	40	planar	planar	ADJ
ecletica-1369	68	41	,	,	PUNCT
ecletica-1369	68	42	especially	especially	ADV
ecletica-1369	68	43	the	the	DET
ecletica-1369	68	44	crvbbt	crvbbt	NOUN
ecletica-1369	68	45	based	base	VERB
ecletica-1369	68	46	compounds	compound	NOUN
ecletica-1369	68	47	,	,	PUNCT
ecletica-1369	68	48	whose	whose	DET
ecletica-1369	68	49	values	value	NOUN
ecletica-1369	68	50	are	be	AUX
ecletica-1369	68	51	179.94	179.94	NUM
ecletica-1369	68	52	,	,	PUNCT
ecletica-1369	68	53	179.88	179.88	NUM
ecletica-1369	68	54	,	,	PUNCT
ecletica-1369	68	55	and	and	CCONJ
ecletica-1369	68	56	179.85	179.85	NUM
ecletica-1369	68	57	°	°	NOUN
ecletica-1369	68	58	for	for	ADP
ecletica-1369	68	59	the	the	DET
ecletica-1369	68	60	neutral	neutral	ADJ
ecletica-1369	68	61	,	,	PUNCT
ecletica-1369	68	62	cationic	cationic	ADJ
ecletica-1369	68	63	and	and	CCONJ
ecletica-1369	68	64	anionic	anionic	ADJ
ecletica-1369	68	65	structure	structure	NOUN
ecletica-1369	68	66	,	,	PUNCT
ecletica-1369	68	67	respectively	respectively	ADV
ecletica-1369	68	68	.	.	PUNCT
ecletica-1369	69	1	it	it	PRON
ecletica-1369	69	2	is	be	AUX
ecletica-1369	69	3	concluded	conclude	VERB
ecletica-1369	69	4	that	that	SCONJ
ecletica-1369	69	5	the	the	DET
ecletica-1369	69	6	neutral	neutral	ADJ
ecletica-1369	69	7	states	state	NOUN
ecletica-1369	69	8	tend	tend	VERB
ecletica-1369	69	9	towards	towards	ADP
ecletica-1369	69	10	flat	flat	ADJ
ecletica-1369	69	11	and	and	CCONJ
ecletica-1369	69	12	rigid	rigid	ADJ
ecletica-1369	69	13	structures	structure	NOUN
ecletica-1369	69	14	.	.	PUNCT
ecletica-1369	70	1	in	in	ADP
ecletica-1369	70	2	addition	addition	NOUN
ecletica-1369	70	3	,	,	PUNCT
ecletica-1369	70	4	a	a	DET
ecletica-1369	70	5	dramatic	dramatic	ADJ
ecletica-1369	70	6	reduction	reduction	NOUN
ecletica-1369	70	7	of	of	ADP
ecletica-1369	70	8	the	the	DET
ecletica-1369	70	9	bond	bond	NOUN
ecletica-1369	70	10	length	length	NOUN
ecletica-1369	70	11	from	from	ADP
ecletica-1369	70	12	the	the	DET
ecletica-1369	70	13	neutral	neutral	ADJ
ecletica-1369	70	14	to	to	ADP
ecletica-1369	70	15	the	the	DET
ecletica-1369	70	16	anionic	anionic	ADJ
ecletica-1369	70	17	or	or	CCONJ
ecletica-1369	70	18	cationic	cationic	ADJ
ecletica-1369	70	19	state	state	NOUN
ecletica-1369	70	20	was	be	AUX
ecletica-1369	70	21	observed	observe	VERB
ecletica-1369	70	22	in	in	ADP
ecletica-1369	70	23	fig	fig	NOUN
ecletica-1369	70	24	.	.	PUNCT
ecletica-1369	71	1	5	5	NUM
ecletica-1369	71	2	.	.	X
ecletica-1369	71	3	as	as	ADV
ecletica-1369	71	4	well	well	ADV
ecletica-1369	71	5	as	as	ADP
ecletica-1369	71	6	the	the	DET
ecletica-1369	71	7	introduction	introduction	NOUN
ecletica-1369	71	8	of	of	ADP
ecletica-1369	71	9	the	the	DET
ecletica-1369	71	10	groups	group	NOUN
ecletica-1369	71	11	containing	contain	VERB
ecletica-1369	71	12	nitrogen	nitrogen	NOUN
ecletica-1369	71	13	atoms	atom	NOUN
ecletica-1369	71	14	at	at	ADP
ecletica-1369	71	15	the	the	DET
ecletica-1369	71	16	terminal	terminal	NOUN
ecletica-1369	71	17	of	of	ADP
ecletica-1369	71	18	the	the	DET
ecletica-1369	71	19	vinyl	vinyl	NOUN
ecletica-1369	71	20	,	,	PUNCT
ecletica-1369	71	21	would	would	AUX
ecletica-1369	71	22	give	give	VERB
ecletica-1369	71	23	more	more	ADJ
ecletica-1369	71	24	flatness	flatness	NOUN
ecletica-1369	71	25	to	to	ADP
ecletica-1369	71	26	the	the	DET
ecletica-1369	71	27	molecular	molecular	ADJ
ecletica-1369	71	28	skeleton	skeleton	NOUN
ecletica-1369	71	29	,	,	PUNCT
ecletica-1369	71	30	so	so	ADV
ecletica-1369	71	31	all	all	DET
ecletica-1369	71	32	the	the	DET
ecletica-1369	71	33	bonds	bond	NOUN
ecletica-1369	71	34	are	be	AUX
ecletica-1369	71	35	kept	keep	VERB
ecletica-1369	71	36	short	short	ADV
ecletica-1369	71	37	of	of	ADP
ecletica-1369	71	38	about	about	ADV
ecletica-1369	71	39	1.44	1.44	NUM
ecletica-1369	71	40	å	å	NOUN
ecletica-1369	71	41	between	between	ADP
ecletica-1369	71	42	oligomer	oligomer	PROPN
ecletica-1369	71	43	crv	crv	PROPN
ecletica-1369	71	44	-	-	PUNCT
ecletica-1369	71	45	bbt	bbt	PROPN
ecletica-1369	71	46	and	and	CCONJ
ecletica-1369	71	47	the	the	DET
ecletica-1369	71	48	vinyl	vinyl	NOUN
ecletica-1369	71	49	unit	unit	NOUN
ecletica-1369	71	50	.	.	PUNCT
ecletica-1369	72	1	this	this	DET
ecletica-1369	72	2	shortening	shortening	NOUN
ecletica-1369	72	3	is	be	AUX
ecletica-1369	72	4	attributed	attribute	VERB
ecletica-1369	72	5	to	to	ADP
ecletica-1369	72	6	the	the	DET
ecletica-1369	72	7	size	size	NOUN
ecletica-1369	72	8	and	and	CCONJ
ecletica-1369	72	9	electronegativity	electronegativity	NOUN
ecletica-1369	72	10	of	of	ADP
ecletica-1369	72	11	the	the	DET
ecletica-1369	72	12	nitrogen	nitrogen	NOUN
ecletica-1369	72	13	atom	atom	NOUN
ecletica-1369	72	14	,	,	PUNCT
ecletica-1369	72	15	as	as	ADV
ecletica-1369	72	16	well	well	ADV
ecletica-1369	72	17	as	as	ADP
ecletica-1369	72	18	influencing	influence	VERB
ecletica-1369	72	19	the	the	DET
ecletica-1369	72	20	electron	electron	NOUN
ecletica-1369	72	21	density	density	NOUN
ecletica-1369	72	22	distribution	distribution	NOUN
ecletica-1369	72	23	.	.	PUNCT
ecletica-1369	73	1	dipole	dipole	NOUN
ecletica-1369	73	2	moments	moment	NOUN
ecletica-1369	73	3	can	can	AUX
ecletica-1369	73	4	explain	explain	VERB
ecletica-1369	73	5	charge	charge	NOUN
ecletica-1369	73	6	transport	transport	NOUN
ecletica-1369	73	7	properties	property	NOUN
ecletica-1369	73	8	.	.	PUNCT
ecletica-1369	74	1	thus	thus	ADV
ecletica-1369	74	2	,	,	PUNCT
ecletica-1369	74	3	fig	fig	NOUN
ecletica-1369	74	4	.	.	PUNCT
ecletica-1369	74	5	7	7	NUM
ecletica-1369	74	6	indicates	indicate	VERB
ecletica-1369	74	7	that	that	SCONJ
ecletica-1369	74	8	the	the	DET
ecletica-1369	74	9	dipole	dipole	NOUN
ecletica-1369	74	10	moment	moment	NOUN
ecletica-1369	74	11	of	of	ADP
ecletica-1369	74	12	oligomers	oligomer	NOUN
ecletica-1369	74	13	with	with	ADP
ecletica-1369	74	14	planar	planar	ADJ
ecletica-1369	74	15	structures	structure	NOUN
ecletica-1369	74	16	is	be	AUX
ecletica-1369	74	17	higher	high	ADJ
ecletica-1369	74	18	than	than	ADP
ecletica-1369	74	19	that	that	PRON
ecletica-1369	74	20	of	of	ADP
ecletica-1369	74	21	other	other	ADJ
ecletica-1369	74	22	oligomers	oligomer	NOUN
ecletica-1369	74	23	in	in	ADP
ecletica-1369	74	24	the	the	DET
ecletica-1369	74	25	neutral	neutral	ADJ
ecletica-1369	74	26	state	state	NOUN
ecletica-1369	74	27	.	.	PUNCT
ecletica-1369	75	1	this	this	PRON
ecletica-1369	75	2	means	mean	VERB
ecletica-1369	75	3	that	that	SCONJ
ecletica-1369	75	4	crvbbt	crvbbt	NOUN
ecletica-1369	75	5	and	and	CCONJ
ecletica-1369	75	6	crv	crv	PROPN
ecletica-1369	75	7	-	-	PUNCT
ecletica-1369	75	8	ttn	ttn	PROPN
ecletica-1369	75	9	,	,	PUNCT
ecletica-1369	75	10	which	which	PRON
ecletica-1369	75	11	show	show	VERB
ecletica-1369	75	12	high	high	ADJ
ecletica-1369	75	13	dipole	dipole	NOUN
ecletica-1369	75	14	moments	moment	NOUN
ecletica-1369	75	15	,	,	PUNCT
ecletica-1369	75	16	indicate	indicate	VERB
ecletica-1369	75	17	the	the	DET
ecletica-1369	75	18	presence	presence	NOUN
ecletica-1369	75	19	of	of	ADP
ecletica-1369	75	20	significant	significant	ADJ
ecletica-1369	75	21	charge	charge	NOUN
ecletica-1369	75	22	transfer	transfer	NOUN
ecletica-1369	75	23	.	.	PUNCT
ecletica-1369	76	1	figure	figure	NOUN
ecletica-1369	76	2	7	7	NUM
ecletica-1369	76	3	.	.	PUNCT
ecletica-1369	76	4	dipole	dipole	NOUN
ecletica-1369	76	5	moment	moment	NOUN
ecletica-1369	76	6	of	of	ADP
ecletica-1369	76	7	oligomers	oligomer	NOUN
ecletica-1369	76	8	in	in	ADP
ecletica-1369	76	9	the	the	DET
ecletica-1369	76	10	neutral	neutral	ADJ
ecletica-1369	76	11	and	and	CCONJ
ecletica-1369	76	12	charged	charge	VERB
ecletica-1369	76	13	state	state	NOUN
ecletica-1369	76	14	obtained	obtain	VERB
ecletica-1369	76	15	by	by	ADP
ecletica-1369	76	16	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	76	17	-	-	PROPN
ecletica-1369	76	18	31	31	NUM
ecletica-1369	76	19	g	g	NOUN
ecletica-1369	76	20	(	(	PUNCT
ecletica-1369	76	21	d	d	PROPN
ecletica-1369	76	22	,	,	PUNCT
ecletica-1369	76	23	p	p	NOUN
ecletica-1369	76	24	)	)	PUNCT
ecletica-1369	76	25	.	.	PUNCT
ecletica-1369	77	1	when	when	SCONJ
ecletica-1369	77	2	the	the	DET
ecletica-1369	77	3	ground	ground	NOUN
ecletica-1369	77	4	states	state	NOUN
ecletica-1369	77	5	are	be	AUX
ecletica-1369	77	6	excited	excite	VERB
ecletica-1369	77	7	a	a	DET
ecletica-1369	77	8	sharp	sharp	ADJ
ecletica-1369	77	9	change	change	NOUN
ecletica-1369	77	10	in	in	ADP
ecletica-1369	77	11	dipole	dipole	NOUN
ecletica-1369	77	12	moment	moment	NOUN
ecletica-1369	77	13	takes	take	VERB
ecletica-1369	77	14	place	place	NOUN
ecletica-1369	77	15	which	which	PRON
ecletica-1369	77	16	would	would	AUX
ecletica-1369	77	17	have	have	VERB
ecletica-1369	77	18	a	a	DET
ecletica-1369	77	19	change	change	NOUN
ecletica-1369	77	20	in	in	ADP
ecletica-1369	77	21	the	the	DET
ecletica-1369	77	22	degree	degree	NOUN
ecletica-1369	77	23	of	of	ADP
ecletica-1369	77	24	intermolecular	intermolecular	ADJ
ecletica-1369	77	25	charge	charge	NOUN
ecletica-1369	77	26	transfer	transfer	NOUN
ecletica-1369	77	27	.	.	PUNCT
ecletica-1369	78	1	the	the	DET
ecletica-1369	78	2	dipole	dipole	NOUN
ecletica-1369	78	3	moment	moment	NOUN
ecletica-1369	78	4	of	of	ADP
ecletica-1369	78	5	the	the	DET
ecletica-1369	78	6	oligomers	oligomer	NOUN
ecletica-1369	78	7	in	in	ADP
ecletica-1369	78	8	the	the	DET
ecletica-1369	78	9	neutral	neutral	ADJ
ecletica-1369	78	10	and	and	CCONJ
ecletica-1369	78	11	charged	charge	VERB
ecletica-1369	78	12	states	state	NOUN
ecletica-1369	78	13	were	be	AUX
ecletica-1369	78	14	calculated	calculate	VERB
ecletica-1369	78	15	.	.	PUNCT
ecletica-1369	79	1	the	the	DET
ecletica-1369	79	2	values	value	NOUN
ecletica-1369	79	3	are	be	AUX
ecletica-1369	79	4	presented	present	VERB
ecletica-1369	79	5	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	79	6	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	NOUN
ecletica-1369	79	7	original	original	ADJ
ecletica-1369	79	8	article	article	NOUN
ecletica-1369	79	9	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1369	79	10	60	60	NUM
ecletica-1369	79	11	eclética	eclética	PROPN
ecletica-1369	79	12	química	química	PROPN
ecletica-1369	79	13	journal	journal	PROPN
ecletica-1369	79	14	,	,	PUNCT
ecletica-1369	79	15	vol	vol	NOUN
ecletica-1369	79	16	.	.	PROPN
ecletica-1369	80	1	47	47	NUM
ecletica-1369	80	2	,	,	PUNCT
ecletica-1369	80	3	n.	n.	NOUN
ecletica-1369	80	4	4	4	NUM
ecletica-1369	80	5	,	,	PUNCT
ecletica-1369	80	6	2022	2022	NUM
ecletica-1369	80	7	,	,	PUNCT
ecletica-1369	80	8	55	55	NUM
ecletica-1369	80	9	-	-	SYM
ecletica-1369	80	10	68	68	NUM
ecletica-1369	80	11	issn	issn	NOUN
ecletica-1369	80	12	:	:	PUNCT
ecletica-1369	80	13	1678	1678	NUM
ecletica-1369	80	14	-	-	SYM
ecletica-1369	80	15	4618	4618	NUM
ecletica-1369	80	16	doi	doi	NOUN
ecletica-1369	80	17	:	:	PUNCT
ecletica-1369	80	18	10.26850/1678	10.26850/1678	NUM
ecletica-1369	80	19	-	-	SYM
ecletica-1369	80	20	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	80	21	-	-	PUNCT
ecletica-1369	80	22	68	68	NUM
ecletica-1369	80	23	in	in	ADP
ecletica-1369	80	24	fig	fig	NOUN
ecletica-1369	80	25	.	.	PUNCT
ecletica-1369	81	1	7	7	X
ecletica-1369	81	2	.	.	X
ecletica-1369	81	3	it	it	PRON
ecletica-1369	81	4	is	be	AUX
ecletica-1369	81	5	clear	clear	ADJ
ecletica-1369	81	6	that	that	SCONJ
ecletica-1369	81	7	crv	crv	PROPN
ecletica-1369	81	8	-	-	PUNCT
ecletica-1369	81	9	bbt	bbt	PROPN
ecletica-1369	81	10	and	and	CCONJ
ecletica-1369	81	11	crv	crv	PROPN
ecletica-1369	81	12	-	-	PUNCT
ecletica-1369	81	13	ttn	ttn	PROPN
ecletica-1369	81	14	have	have	VERB
ecletica-1369	81	15	the	the	DET
ecletica-1369	81	16	highest	high	ADJ
ecletica-1369	81	17	values	value	NOUN
ecletica-1369	81	18	of	of	ADP
ecletica-1369	81	19	the	the	DET
ecletica-1369	81	20	dipole	dipole	NOUN
ecletica-1369	81	21	moments	moment	NOUN
ecletica-1369	81	22	,	,	PUNCT
ecletica-1369	81	23	which	which	PRON
ecletica-1369	81	24	make	make	VERB
ecletica-1369	81	25	their	their	PRON
ecletica-1369	81	26	excited	excited	ADJ
ecletica-1369	81	27	states	state	NOUN
ecletica-1369	81	28	highly	highly	ADV
ecletica-1369	81	29	polarized	polarize	VERB
ecletica-1369	81	30	and	and	CCONJ
ecletica-1369	81	31	facilitate	facilitate	VERB
ecletica-1369	81	32	the	the	DET
ecletica-1369	81	33	charge	charge	NOUN
ecletica-1369	81	34	transport	transport	NOUN
ecletica-1369	81	35	.	.	PUNCT
ecletica-1369	82	1	these	these	DET
ecletica-1369	82	2	results	result	NOUN
ecletica-1369	82	3	agree	agree	VERB
ecletica-1369	82	4	with	with	ADP
ecletica-1369	82	5	the	the	DET
ecletica-1369	82	6	reorganization	reorganization	NOUN
ecletica-1369	82	7	energy	energy	NOUN
ecletica-1369	82	8	.	.	PUNCT
ecletica-1369	83	1	in	in	ADP
ecletica-1369	83	2	the	the	DET
ecletica-1369	83	3	excited	excited	ADJ
ecletica-1369	83	4	state	state	NOUN
ecletica-1369	83	5	,	,	PUNCT
ecletica-1369	83	6	the	the	DET
ecletica-1369	83	7	negative	negative	ADJ
ecletica-1369	83	8	charge	charge	NOUN
ecletica-1369	83	9	tends	tend	VERB
ecletica-1369	83	10	to	to	PART
ecletica-1369	83	11	localize	localize	VERB
ecletica-1369	83	12	on	on	ADP
ecletica-1369	83	13	the	the	DET
ecletica-1369	83	14	acceptor	acceptor	NOUN
ecletica-1369	83	15	unit	unit	NOUN
ecletica-1369	83	16	(	(	PUNCT
ecletica-1369	83	17	a	a	X
ecletica-1369	83	18	)	)	PUNCT
ecletica-1369	83	19	while	while	SCONJ
ecletica-1369	83	20	the	the	DET
ecletica-1369	83	21	positive	positive	ADJ
ecletica-1369	83	22	charge	charge	NOUN
ecletica-1369	83	23	tends	tend	VERB
ecletica-1369	83	24	to	to	PART
ecletica-1369	83	25	localize	localize	VERB
ecletica-1369	83	26	on	on	ADP
ecletica-1369	83	27	the	the	DET
ecletica-1369	83	28	donor	donor	NOUN
ecletica-1369	83	29	(	(	PUNCT
ecletica-1369	83	30	d	d	NOUN
ecletica-1369	83	31	)	)	PUNCT
ecletica-1369	83	32	.	.	PUNCT
ecletica-1369	84	1	the	the	DET
ecletica-1369	84	2	large	large	ADJ
ecletica-1369	84	3	separation	separation	NOUN
ecletica-1369	84	4	between	between	ADP
ecletica-1369	84	5	the	the	DET
ecletica-1369	84	6	negative	negative	ADJ
ecletica-1369	84	7	and	and	CCONJ
ecletica-1369	84	8	positive	positive	ADJ
ecletica-1369	84	9	charges	charge	NOUN
ecletica-1369	84	10	after	after	SCONJ
ecletica-1369	84	11	excitation	excitation	NOUN
ecletica-1369	84	12	reduces	reduce	VERB
ecletica-1369	84	13	the	the	DET
ecletica-1369	84	14	d	d	NOUN
ecletica-1369	84	15	-	-	PUNCT
ecletica-1369	84	16	a	a	DET
ecletica-1369	84	17	binding	bind	VERB
ecletica-1369	84	18	energy	energy	NOUN
ecletica-1369	84	19	which	which	PRON
ecletica-1369	84	20	facilitates	facilitate	VERB
ecletica-1369	84	21	exciton	exciton	NOUN
ecletica-1369	84	22	dissociation	dissociation	NOUN
ecletica-1369	84	23	and	and	CCONJ
ecletica-1369	84	24	transport	transport	NOUN
ecletica-1369	84	25	.	.	PUNCT
ecletica-1369	85	1	conversely	conversely	ADV
ecletica-1369	85	2	,	,	PUNCT
ecletica-1369	85	3	the	the	DET
ecletica-1369	85	4	recombination	recombination	NOUN
ecletica-1369	85	5	rate	rate	NOUN
ecletica-1369	85	6	is	be	AUX
ecletica-1369	85	7	high	high	ADJ
ecletica-1369	85	8	and	and	CCONJ
ecletica-1369	85	9	fast	fast	ADJ
ecletica-1369	85	10	in	in	ADP
ecletica-1369	85	11	compounds	compound	NOUN
ecletica-1369	85	12	with	with	ADP
ecletica-1369	85	13	low	low	ADJ
ecletica-1369	85	14	dipole	dipole	NOUN
ecletica-1369	85	15	moment	moment	NOUN
ecletica-1369	85	16	,	,	PUNCT
ecletica-1369	85	17	which	which	PRON
ecletica-1369	85	18	indicates	indicate	VERB
ecletica-1369	85	19	that	that	SCONJ
ecletica-1369	85	20	electrons	electron	NOUN
ecletica-1369	85	21	and	and	CCONJ
ecletica-1369	85	22	holes	hole	NOUN
ecletica-1369	85	23	are	be	AUX
ecletica-1369	85	24	more	more	ADV
ecletica-1369	85	25	bound	bind	VERB
ecletica-1369	85	26	in	in	ADP
ecletica-1369	85	27	compounds	compound	NOUN
ecletica-1369	85	28	with	with	ADP
ecletica-1369	85	29	high	high	ADJ
ecletica-1369	85	30	dipole	dipole	NOUN
ecletica-1369	85	31	moment	moment	NOUN
ecletica-1369	85	32	value	value	NOUN
ecletica-1369	85	33	namely	namely	ADV
ecletica-1369	85	34	crv	crv	PROPN
ecletica-1369	85	35	-	-	PUNCT
ecletica-1369	85	36	bbt	bbt	PROPN
ecletica-1369	85	37	and	and	CCONJ
ecletica-1369	85	38	crv	crv	PROPN
ecletica-1369	85	39	-	-	PUNCT
ecletica-1369	85	40	ttn	ttn	PROPN
ecletica-1369	85	41	than	than	ADP
ecletica-1369	85	42	in	in	ADP
ecletica-1369	85	43	other	other	ADJ
ecletica-1369	85	44	compounds	compound	NOUN
ecletica-1369	85	45	with	with	ADP
ecletica-1369	85	46	low	low	ADJ
ecletica-1369	85	47	dipole	dipole	NOUN
ecletica-1369	85	48	moment	moment	NOUN
ecletica-1369	85	49	.	.	PUNCT
ecletica-1369	86	1	3.2	3.2	NUM
ecletica-1369	87	1	the	the	DET
ecletica-1369	87	2	boundary	boundary	ADJ
ecletica-1369	87	3	orbitals	orbital	NOUN
ecletica-1369	87	4	figure	figure	VERB
ecletica-1369	87	5	8	8	NUM
ecletica-1369	87	6	presents	present	VERB
ecletica-1369	87	7	the	the	DET
ecletica-1369	87	8	electronic	electronic	ADJ
ecletica-1369	87	9	density	density	NOUN
ecletica-1369	87	10	of	of	ADP
ecletica-1369	87	11	the	the	DET
ecletica-1369	87	12	homo	homo	NOUN
ecletica-1369	87	13	and	and	CCONJ
ecletica-1369	87	14	lumo	lumo	NOUN
ecletica-1369	87	15	orbitals	orbital	NOUN
ecletica-1369	87	16	of	of	ADP
ecletica-1369	87	17	the	the	DET
ecletica-1369	87	18	studied	studied	ADJ
ecletica-1369	87	19	oligomers	oligomer	NOUN
ecletica-1369	87	20	,	,	PUNCT
ecletica-1369	87	21	which	which	PRON
ecletica-1369	87	22	give	give	VERB
ecletica-1369	87	23	a	a	DET
ecletica-1369	87	24	qualitative	qualitative	ADJ
ecletica-1369	87	25	and	and	CCONJ
ecletica-1369	87	26	rational	rational	ADJ
ecletica-1369	87	27	indication	indication	NOUN
ecletica-1369	87	28	of	of	ADP
ecletica-1369	87	29	the	the	DET
ecletica-1369	87	30	electronic	electronic	ADJ
ecletica-1369	87	31	properties	property	NOUN
ecletica-1369	87	32	of	of	ADP
ecletica-1369	87	33	the	the	DET
ecletica-1369	87	34	studied	study	VERB
ecletica-1369	87	35	oligomers	oligomer	NOUN
ecletica-1369	87	36	.	.	PUNCT
ecletica-1369	88	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	88	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	VERB
ecletica-1369	88	3	original	original	ADJ
ecletica-1369	88	4	article	article	NOUN
ecletica-1369	88	5	revista.iq.unesp.br	revista.iq.unesp.br	PUNCT
ecletica-1369	88	6	61	61	NUM
ecletica-1369	88	7	eclética	eclética	PROPN
ecletica-1369	88	8	química	química	PROPN
ecletica-1369	88	9	journal	journal	PROPN
ecletica-1369	88	10	,	,	PUNCT
ecletica-1369	88	11	vol	vol	NOUN
ecletica-1369	88	12	.	.	PROPN
ecletica-1369	88	13	47	47	NUM
ecletica-1369	88	14	,	,	PUNCT
ecletica-1369	88	15	n.	n.	NOUN
ecletica-1369	88	16	4	4	NUM
ecletica-1369	88	17	,	,	PUNCT
ecletica-1369	88	18	2022	2022	NUM
ecletica-1369	88	19	,	,	PUNCT
ecletica-1369	88	20	55	55	NUM
ecletica-1369	88	21	-	-	SYM
ecletica-1369	88	22	68	68	NUM
ecletica-1369	88	23	issn	issn	NOUN
ecletica-1369	88	24	:	:	PUNCT
ecletica-1369	88	25	1678	1678	NUM
ecletica-1369	88	26	-	-	SYM
ecletica-1369	88	27	4618	4618	NUM
ecletica-1369	88	28	doi	doi	NOUN
ecletica-1369	88	29	:	:	PUNCT
ecletica-1369	88	30	10.26850/1678	10.26850/1678	NUM
ecletica-1369	88	31	-	-	SYM
ecletica-1369	88	32	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	88	33	-	-	PUNCT
ecletica-1369	88	34	68	68	NUM
ecletica-1369	88	35	figure	figure	NOUN
ecletica-1369	88	36	8	8	NUM
ecletica-1369	88	37	.	.	PUNCT
ecletica-1369	89	1	the	the	DET
ecletica-1369	89	2	contour	contour	NOUN
ecletica-1369	89	3	plots	plot	NOUN
ecletica-1369	89	4	of	of	ADP
ecletica-1369	89	5	homo	homo	NOUN
ecletica-1369	89	6	(	(	PUNCT
ecletica-1369	89	7	a	a	DET
ecletica-1369	89	8	,	,	PUNCT
ecletica-1369	89	9	c	c	NOUN
ecletica-1369	89	10	,	,	PUNCT
ecletica-1369	89	11	e	e	NOUN
ecletica-1369	89	12	,	,	PUNCT
ecletica-1369	89	13	g	g	PROPN
ecletica-1369	89	14	,	,	PUNCT
ecletica-1369	89	15	i	i	PRON
ecletica-1369	89	16	,	,	PUNCT
ecletica-1369	89	17	k	k	PROPN
ecletica-1369	89	18	)	)	PUNCT
ecletica-1369	89	19	and	and	CCONJ
ecletica-1369	89	20	lumo	lumo	NOUN
ecletica-1369	89	21	(	(	PUNCT
ecletica-1369	89	22	b	b	NOUN
ecletica-1369	89	23	,	,	PUNCT
ecletica-1369	89	24	d	d	PROPN
ecletica-1369	89	25	,	,	PUNCT
ecletica-1369	89	26	f	f	X
ecletica-1369	89	27	,	,	PUNCT
ecletica-1369	89	28	h	h	PROPN
ecletica-1369	89	29	,	,	PUNCT
ecletica-1369	89	30	j	j	PROPN
ecletica-1369	89	31	,	,	PUNCT
ecletica-1369	89	32	l	l	NOUN
ecletica-1369	89	33	)	)	PUNCT
ecletica-1369	89	34	orbitals	orbital	NOUN
ecletica-1369	89	35	of	of	ADP
ecletica-1369	89	36	the	the	DET
ecletica-1369	89	37	studied	study	VERB
ecletica-1369	89	38	oligomers	oligomer	NOUN
ecletica-1369	89	39	by	by	ADP
ecletica-1369	89	40	dft	dft	PROPN
ecletica-1369	89	41	/	/	SYM
ecletica-1369	89	42	b3lyp	b3lyp	PROPN
ecletica-1369	89	43	6	6	NUM
ecletica-1369	89	44	-	-	SYM
ecletica-1369	89	45	31	31	NUM
ecletica-1369	89	46	g	g	NOUN
ecletica-1369	89	47	(	(	PUNCT
ecletica-1369	89	48	d	d	PROPN
ecletica-1369	89	49	,	,	PUNCT
ecletica-1369	89	50	p	p	NOUN
ecletica-1369	89	51	)	)	PUNCT
ecletica-1369	89	52	.	.	PUNCT
ecletica-1369	90	1	source	source	NOUN
ecletica-1369	90	2	:	:	PUNCT
ecletica-1369	90	3	adapted	adapt	VERB
ecletica-1369	90	4	from	from	ADP
ecletica-1369	90	5	jabha	jabha	PROPN
ecletica-1369	90	6	et	et	PROPN
ecletica-1369	90	7	al	al	PROPN
ecletica-1369	90	8	.	.	PROPN
ecletica-1369	90	9	(	(	PUNCT
ecletica-1369	90	10	2022	2022	NUM
ecletica-1369	90	11	)	)	PUNCT
ecletica-1369	90	12	.	.	PUNCT
ecletica-1369	91	1	the	the	DET
ecletica-1369	91	2	propagation	propagation	NOUN
ecletica-1369	91	3	of	of	ADP
ecletica-1369	91	4	the	the	DET
ecletica-1369	91	5	electron	electron	NOUN
ecletica-1369	91	6	density	density	NOUN
ecletica-1369	91	7	appears	appear	VERB
ecletica-1369	91	8	very	very	ADV
ecletica-1369	91	9	clearly	clearly	ADV
ecletica-1369	91	10	in	in	ADP
ecletica-1369	91	11	fig	fig	NOUN
ecletica-1369	91	12	.	.	PUNCT
ecletica-1369	92	1	8	8	X
ecletica-1369	92	2	.	.	PUNCT
ecletica-1369	93	1	the	the	DET
ecletica-1369	93	2	electron	electron	NOUN
ecletica-1369	93	3	density	density	NOUN
ecletica-1369	93	4	of	of	ADP
ecletica-1369	93	5	the	the	DET
ecletica-1369	93	6	lumo	lumo	NOUN
ecletica-1369	93	7	is	be	AUX
ecletica-1369	93	8	stronger	strong	ADJ
ecletica-1369	93	9	around	around	ADP
ecletica-1369	93	10	the	the	DET
ecletica-1369	93	11	nitrogenous	nitrogenous	ADJ
ecletica-1369	93	12	group	group	NOUN
ecletica-1369	93	13	,	,	PUNCT
ecletica-1369	93	14	on	on	ADP
ecletica-1369	93	15	the	the	DET
ecletica-1369	93	16	other	other	ADJ
ecletica-1369	93	17	hand	hand	NOUN
ecletica-1369	93	18	the	the	DET
ecletica-1369	93	19	systems	system	NOUN
ecletica-1369	93	20	related	relate	VERB
ecletica-1369	93	21	to	to	ADP
ecletica-1369	93	22	groups	group	NOUN
ecletica-1369	93	23	possessing	possess	VERB
ecletica-1369	93	24	the	the	DET
ecletica-1369	93	25	thiophene	thiophene	NOUN
ecletica-1369	93	26	are	be	AUX
ecletica-1369	93	27	characterized	characterize	VERB
ecletica-1369	93	28	by	by	ADP
ecletica-1369	93	29	electron	electron	NOUN
ecletica-1369	93	30	densities	density	NOUN
ecletica-1369	93	31	spread	spread	VERB
ecletica-1369	93	32	out	out	ADP
ecletica-1369	93	33	on	on	ADP
ecletica-1369	93	34	the	the	DET
ecletica-1369	93	35	whole	whole	ADJ
ecletica-1369	93	36	carbon	carbon	NOUN
ecletica-1369	93	37	skeleton	skeleton	NOUN
ecletica-1369	93	38	.	.	PUNCT
ecletica-1369	94	1	thus	thus	ADV
ecletica-1369	94	2	,	,	PUNCT
ecletica-1369	94	3	at	at	ADP
ecletica-1369	94	4	the	the	DET
ecletica-1369	94	5	homo	homo	NOUN
ecletica-1369	94	6	level	level	NOUN
ecletica-1369	94	7	,	,	PUNCT
ecletica-1369	94	8	the	the	DET
ecletica-1369	94	9	electron	electron	NOUN
ecletica-1369	94	10	density	density	NOUN
ecletica-1369	94	11	is	be	AUX
ecletica-1369	94	12	spread	spread	VERB
ecletica-1369	94	13	over	over	ADP
ecletica-1369	94	14	the	the	DET
ecletica-1369	94	15	whole	whole	ADJ
ecletica-1369	94	16	skeleton	skeleton	NOUN
ecletica-1369	94	17	of	of	ADP
ecletica-1369	94	18	the	the	DET
ecletica-1369	94	19	system	system	NOUN
ecletica-1369	94	20	.	.	PUNCT
ecletica-1369	95	1	it	it	PRON
ecletica-1369	95	2	is	be	AUX
ecletica-1369	95	3	important	important	ADJ
ecletica-1369	95	4	to	to	PART
ecletica-1369	95	5	notice	notice	VERB
ecletica-1369	95	6	the	the	DET
ecletica-1369	95	7	absence	absence	NOUN
ecletica-1369	95	8	of	of	ADP
ecletica-1369	95	9	electron	electron	NOUN
ecletica-1369	95	10	density	density	NOUN
ecletica-1369	95	11	on	on	ADP
ecletica-1369	95	12	the	the	DET
ecletica-1369	95	13	chain	chain	NOUN
ecletica-1369	95	14	linked	link	VERB
ecletica-1369	95	15	to	to	ADP
ecletica-1369	95	16	the	the	DET
ecletica-1369	95	17	carbazole	carbazole	NOUN
ecletica-1369	95	18	nitrogen	nitrogen	PROPN
ecletica-1369	95	19	(	(	PUNCT
ecletica-1369	95	20	n	n	CCONJ
ecletica-1369	95	21	)	)	PUNCT
ecletica-1369	95	22	.	.	PUNCT
ecletica-1369	96	1	thus	thus	ADV
ecletica-1369	96	2	,	,	PUNCT
ecletica-1369	96	3	this	this	DET
ecletica-1369	96	4	chain	chain	NOUN
ecletica-1369	96	5	does	do	AUX
ecletica-1369	96	6	not	not	PART
ecletica-1369	96	7	present	present	VERB
ecletica-1369	96	8	any	any	DET
ecletica-1369	96	9	optical	optical	ADJ
ecletica-1369	96	10	effect	effect	NOUN
ecletica-1369	96	11	.	.	PUNCT
ecletica-1369	97	1	it	it	PRON
ecletica-1369	97	2	plays	play	VERB
ecletica-1369	97	3	,	,	PUNCT
ecletica-1369	97	4	perhaps	perhaps	ADV
ecletica-1369	97	5	,	,	PUNCT
ecletica-1369	97	6	a	a	DET
ecletica-1369	97	7	role	role	NOUN
ecletica-1369	97	8	of	of	ADP
ecletica-1369	97	9	solubilization	solubilization	NOUN
ecletica-1369	97	10	and	and	CCONJ
ecletica-1369	97	11	stability	stability	NOUN
ecletica-1369	97	12	of	of	ADP
ecletica-1369	97	13	the	the	DET
ecletica-1369	97	14	system	system	NOUN
ecletica-1369	97	15	.	.	PUNCT
ecletica-1369	98	1	3.3	3.3	NUM
ecletica-1369	98	2	electronic	electronic	ADJ
ecletica-1369	98	3	properties	property	NOUN
ecletica-1369	98	4	the	the	DET
ecletica-1369	98	5	electronic	electronic	ADJ
ecletica-1369	98	6	properties	property	NOUN
ecletica-1369	98	7	are	be	AUX
ecletica-1369	98	8	of	of	ADP
ecletica-1369	98	9	fundamental	fundamental	ADJ
ecletica-1369	98	10	importance	importance	NOUN
ecletica-1369	98	11	for	for	ADP
ecletica-1369	98	12	the	the	DET
ecletica-1369	98	13	study	study	NOUN
ecletica-1369	98	14	of	of	ADP
ecletica-1369	98	15	this	this	DET
ecletica-1369	98	16	type	type	NOUN
ecletica-1369	98	17	of	of	ADP
ecletica-1369	98	18	molecules	molecule	NOUN
ecletica-1369	98	19	.	.	PUNCT
ecletica-1369	99	1	thus	thus	ADV
ecletica-1369	99	2	,	,	PUNCT
ecletica-1369	99	3	the	the	DET
ecletica-1369	99	4	knowledge	knowledge	NOUN
ecletica-1369	99	5	of	of	ADP
ecletica-1369	99	6	the	the	DET
ecletica-1369	99	7	energy	energy	NOUN
ecletica-1369	99	8	levels	level	NOUN
ecletica-1369	99	9	of	of	ADP
ecletica-1369	99	10	the	the	DET
ecletica-1369	99	11	homo	homo	NOUN
ecletica-1369	99	12	and	and	CCONJ
ecletica-1369	99	13	lumo	lumo	NOUN
ecletica-1369	99	14	orbitals	orbital	NOUN
ecletica-1369	99	15	is	be	AUX
ecletica-1369	99	16	fundamental	fundamental	ADJ
ecletica-1369	99	17	for	for	SCONJ
ecletica-1369	99	18	the	the	DET
ecletica-1369	99	19	study	study	NOUN
ecletica-1369	99	20	of	of	ADP
ecletica-1369	99	21	the	the	DET
ecletica-1369	99	22	properties	property	NOUN
ecletica-1369	99	23	and	and	CCONJ
ecletica-1369	99	24	feasibility	feasibility	NOUN
ecletica-1369	99	25	of	of	ADP
ecletica-1369	99	26	these	these	DET
ecletica-1369	99	27	oligomers	oligomer	NOUN
ecletica-1369	99	28	to	to	PART
ecletica-1369	99	29	be	be	AUX
ecletica-1369	99	30	used	use	VERB
ecletica-1369	99	31	as	as	ADP
ecletica-1369	99	32	base	base	ADJ
ecletica-1369	99	33	materials	material	NOUN
ecletica-1369	99	34	of	of	ADP
ecletica-1369	99	35	the	the	DET
ecletica-1369	99	36	active	active	ADJ
ecletica-1369	99	37	layer	layer	NOUN
ecletica-1369	99	38	of	of	ADP
ecletica-1369	99	39	organic	organic	ADJ
ecletica-1369	99	40	solar	solar	ADJ
ecletica-1369	99	41	cells	cell	NOUN
ecletica-1369	99	42	(	(	PUNCT
ecletica-1369	99	43	dufil	dufil	PROPN
ecletica-1369	99	44	et	et	PROPN
ecletica-1369	99	45	al	al	PROPN
ecletica-1369	99	46	.	.	PROPN
ecletica-1369	99	47	,	,	PUNCT
ecletica-1369	99	48	2018	2018	NUM
ecletica-1369	99	49	;	;	PUNCT
ecletica-1369	99	50	jabha	jabha	PROPN
ecletica-1369	99	51	et	et	PROPN
ecletica-1369	99	52	al	al	PROPN
ecletica-1369	99	53	.	.	PROPN
ecletica-1369	99	54	,	,	PUNCT
ecletica-1369	99	55	2018	2018	NUM
ecletica-1369	99	56	)	)	PUNCT
ecletica-1369	99	57	.	.	PUNCT
ecletica-1369	100	1	figure	figure	NOUN
ecletica-1369	100	2	9	9	NUM
ecletica-1369	100	3	groups	group	NOUN
ecletica-1369	100	4	the	the	DET
ecletica-1369	100	5	energy	energy	NOUN
ecletica-1369	100	6	levels	level	NOUN
ecletica-1369	100	7	of	of	ADP
ecletica-1369	100	8	the	the	DET
ecletica-1369	100	9	systems	system	NOUN
ecletica-1369	100	10	optimized	optimize	VERB
ecletica-1369	100	11	by	by	ADP
ecletica-1369	100	12	the	the	DET
ecletica-1369	100	13	dft	dft	PROPN
ecletica-1369	100	14	method	method	NOUN
ecletica-1369	100	15	at	at	ADP
ecletica-1369	100	16	the	the	DET
ecletica-1369	100	17	level	level	NOUN
ecletica-1369	100	18	of	of	ADP
ecletica-1369	100	19	the	the	DET
ecletica-1369	100	20	b3lyp	b3lyp	NOUN
ecletica-1369	100	21	functional	functional	ADJ
ecletica-1369	100	22	with	with	ADP
ecletica-1369	100	23	the	the	DET
ecletica-1369	100	24	base	base	NOUN
ecletica-1369	100	25	6	6	NUM
ecletica-1369	100	26	-	-	SYM
ecletica-1369	100	27	31	31	NUM
ecletica-1369	100	28	g	g	NOUN
ecletica-1369	100	29	(	(	PUNCT
ecletica-1369	100	30	d	d	PROPN
ecletica-1369	100	31	,	,	PUNCT
ecletica-1369	100	32	p	p	NOUN
ecletica-1369	100	33	)	)	PUNCT
ecletica-1369	100	34	.	.	PUNCT
ecletica-1369	101	1	the	the	DET
ecletica-1369	101	2	values	value	NOUN
ecletica-1369	101	3	of	of	ADP
ecletica-1369	101	4	eg	eg	NOUN
ecletica-1369	101	5	show	show	VERB
ecletica-1369	101	6	that	that	SCONJ
ecletica-1369	101	7	the	the	DET
ecletica-1369	101	8	oligomers	oligomer	NOUN
ecletica-1369	101	9	having	have	VERB
ecletica-1369	101	10	a	a	DET
ecletica-1369	101	11	group	group	NOUN
ecletica-1369	101	12	different	different	ADJ
ecletica-1369	101	13	from	from	ADP
ecletica-1369	101	14	hydrogen	hydrogen	NOUN
ecletica-1369	101	15	,	,	PUNCT
ecletica-1369	101	16	has	have	VERB
ecletica-1369	101	17	a	a	DET
ecletica-1369	101	18	semiconductor	semiconductor	NOUN
ecletica-1369	101	19	character	character	NOUN
ecletica-1369	101	20	,	,	PUNCT
ecletica-1369	101	21	mainly	mainly	ADV
ecletica-1369	101	22	the	the	DET
ecletica-1369	101	23	crv	crv	PROPN
ecletica-1369	101	24	-	-	PUNCT
ecletica-1369	101	25	bbt	bbt	PROPN
ecletica-1369	101	26	by	by	ADP
ecletica-1369	101	27	the	the	DET
ecletica-1369	101	28	smallest	small	ADJ
ecletica-1369	101	29	value	value	NOUN
ecletica-1369	101	30	of	of	ADP
ecletica-1369	101	31	gap	gap	NOUN
ecletica-1369	101	32	energy	energy	NOUN
ecletica-1369	101	33	(	(	PUNCT
ecletica-1369	101	34	eg	eg	NOUN
ecletica-1369	101	35	=	=	SYM
ecletica-1369	101	36	1.75	1.75	NUM
ecletica-1369	101	37	)	)	PUNCT
ecletica-1369	101	38	.	.	PUNCT
ecletica-1369	102	1	this	this	DET
ecletica-1369	102	2	value	value	NOUN
ecletica-1369	102	3	allows	allow	VERB
ecletica-1369	102	4	a	a	DET
ecletica-1369	102	5	good	good	ADJ
ecletica-1369	102	6	exciton	exciton	NOUN
ecletica-1369	102	7	creation	creation	NOUN
ecletica-1369	102	8	,	,	PUNCT
ecletica-1369	102	9	i.e.	i.e.	X
ecletica-1369	102	10	,	,	PUNCT
ecletica-1369	102	11	excitation	excitation	NOUN
ecletica-1369	102	12	of	of	ADP
ecletica-1369	102	13	the	the	DET
ecletica-1369	102	14	electrons	electron	NOUN
ecletica-1369	102	15	from	from	ADP
ecletica-1369	102	16	the	the	DET
ecletica-1369	102	17	homo	homo	NOUN
ecletica-1369	102	18	to	to	ADP
ecletica-1369	102	19	the	the	DET
ecletica-1369	102	20	lumo	lumo	NOUN
ecletica-1369	102	21	,	,	PUNCT
ecletica-1369	102	22	thus	thus	ADV
ecletica-1369	102	23	the	the	DET
ecletica-1369	102	24	recombination	recombination	NOUN
ecletica-1369	102	25	rate	rate	NOUN
ecletica-1369	102	26	decreases	decrease	NOUN
ecletica-1369	102	27	.	.	PUNCT
ecletica-1369	103	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	103	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	VERB
ecletica-1369	103	3	original	original	ADJ
ecletica-1369	103	4	article	article	NOUN
ecletica-1369	103	5	revista.iq.unesp.br	revista.iq.unesp.br	ADP
ecletica-1369	103	6	62	62	NUM
ecletica-1369	103	7	eclética	eclética	PROPN
ecletica-1369	103	8	química	química	PROPN
ecletica-1369	103	9	journal	journal	PROPN
ecletica-1369	103	10	,	,	PUNCT
ecletica-1369	103	11	vol	vol	NOUN
ecletica-1369	103	12	.	.	PROPN
ecletica-1369	103	13	47	47	NUM
ecletica-1369	103	14	,	,	PUNCT
ecletica-1369	103	15	n.	n.	NOUN
ecletica-1369	103	16	4	4	NUM
ecletica-1369	103	17	,	,	PUNCT
ecletica-1369	103	18	2022	2022	NUM
ecletica-1369	103	19	,	,	PUNCT
ecletica-1369	103	20	55	55	NUM
ecletica-1369	103	21	-	-	SYM
ecletica-1369	103	22	68	68	NUM
ecletica-1369	103	23	issn	issn	NOUN
ecletica-1369	103	24	:	:	PUNCT
ecletica-1369	103	25	1678	1678	NUM
ecletica-1369	103	26	-	-	SYM
ecletica-1369	103	27	4618	4618	NUM
ecletica-1369	103	28	doi	doi	NOUN
ecletica-1369	103	29	:	:	PUNCT
ecletica-1369	103	30	10.26850/1678	10.26850/1678	NUM
ecletica-1369	103	31	-	-	SYM
ecletica-1369	103	32	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	103	33	-	-	PUNCT
ecletica-1369	103	34	68	68	NUM
ecletica-1369	103	35	figure	figure	NOUN
ecletica-1369	103	36	9	9	NUM
ecletica-1369	103	37	.	.	PUNCT
ecletica-1369	104	1	gap	gap	NOUN
ecletica-1369	104	2	energies	energy	NOUN
ecletica-1369	104	3	(	(	PUNCT
ecletica-1369	104	4	eg	eg	NOUN
ecletica-1369	104	5	)	)	PUNCT
ecletica-1369	104	6	calculated	calculate	VERB
ecletica-1369	104	7	by	by	ADP
ecletica-1369	104	8	the	the	DET
ecletica-1369	104	9	dft	dft	PROPN
ecletica-1369	104	10	/	/	SYM
ecletica-1369	104	11	b3lyp/6	b3lyp/6	PROPN
ecletica-1369	104	12	-	-	NOUN
ecletica-1369	104	13	31g(d	31g(d	PROPN
ecletica-1369	104	14	,	,	PUNCT
ecletica-1369	104	15	p	p	NOUN
ecletica-1369	104	16	)	)	PUNCT
ecletica-1369	104	17	method	method	NOUN
ecletica-1369	104	18	.	.	PUNCT
ecletica-1369	105	1	figure	figure	NOUN
ecletica-1369	105	2	10	10	NUM
ecletica-1369	105	3	shows	show	VERB
ecletica-1369	105	4	that	that	SCONJ
ecletica-1369	105	5	the	the	DET
ecletica-1369	105	6	lumo	lumo	NOUN
ecletica-1369	105	7	values	value	NOUN
ecletica-1369	105	8	become	become	VERB
ecletica-1369	105	9	lower	low	ADJ
ecletica-1369	105	10	when	when	SCONJ
ecletica-1369	105	11	moving	move	VERB
ecletica-1369	105	12	from	from	ADP
ecletica-1369	105	13	crv	crv	PROPN
ecletica-1369	105	14	-	-	PUNCT
ecletica-1369	105	15	h	h	NOUN
ecletica-1369	105	16	to	to	ADP
ecletica-1369	105	17	crv	crv	PROPN
ecletica-1369	105	18	-	-	PUNCT
ecletica-1369	105	19	bbt	bbt	PROPN
ecletica-1369	105	20	while	while	SCONJ
ecletica-1369	105	21	the	the	DET
ecletica-1369	105	22	homo	homo	NOUN
ecletica-1369	105	23	varies	vary	VERB
ecletica-1369	105	24	slightly	slightly	ADV
ecletica-1369	105	25	and	and	CCONJ
ecletica-1369	105	26	remains	remain	VERB
ecletica-1369	105	27	stable	stable	ADJ
ecletica-1369	105	28	.	.	PUNCT
ecletica-1369	106	1	the	the	DET
ecletica-1369	106	2	decrease	decrease	NOUN
ecletica-1369	106	3	in	in	ADP
ecletica-1369	106	4	energy	energy	NOUN
ecletica-1369	106	5	of	of	ADP
ecletica-1369	106	6	the	the	DET
ecletica-1369	106	7	lumo	lumo	NOUN
ecletica-1369	106	8	of	of	ADP
ecletica-1369	106	9	crv	crv	PROPN
ecletica-1369	106	10	-	-	PUNCT
ecletica-1369	106	11	bbt	bbt	PROPN
ecletica-1369	106	12	(	(	PUNCT
ecletica-1369	106	13	donor	donor	NOUN
ecletica-1369	106	14	)	)	PUNCT
ecletica-1369	106	15	approaches	approach	VERB
ecletica-1369	106	16	that	that	PRON
ecletica-1369	106	17	of	of	ADP
ecletica-1369	106	18	the	the	DET
ecletica-1369	106	19	acceptor	acceptor	NOUN
ecletica-1369	106	20	unit	unit	NOUN
ecletica-1369	106	21	here	here	ADV
ecletica-1369	106	22	bis	bis	PROPN
ecletica-1369	106	23	-	-	VERB
ecletica-1369	106	24	pcbm	pcbm	PROPN
ecletica-1369	106	25	as	as	SCONJ
ecletica-1369	106	26	shown	show	VERB
ecletica-1369	106	27	in	in	ADP
ecletica-1369	106	28	fig	fig	NOUN
ecletica-1369	106	29	.	.	PUNCT
ecletica-1369	107	1	11	11	NUM
ecletica-1369	107	2	.	.	X
ecletica-1369	107	3	figure	figure	NOUN
ecletica-1369	107	4	10	10	NUM
ecletica-1369	107	5	.	.	PUNCT
ecletica-1369	108	1	evolution	evolution	NOUN
ecletica-1369	108	2	of	of	ADP
ecletica-1369	108	3	energy	energy	NOUN
ecletica-1369	108	4	levels	level	NOUN
ecletica-1369	108	5	with	with	ADP
ecletica-1369	108	6	respect	respect	NOUN
ecletica-1369	108	7	to	to	ADP
ecletica-1369	108	8	the	the	DET
ecletica-1369	108	9	added	add	VERB
ecletica-1369	108	10	r	r	NOUN
ecletica-1369	108	11	group	group	NOUN
ecletica-1369	108	12	.	.	PUNCT
ecletica-1369	109	1	figure	figure	NOUN
ecletica-1369	109	2	11	11	NUM
ecletica-1369	109	3	.	.	PUNCT
ecletica-1369	110	1	position	position	NOUN
ecletica-1369	110	2	of	of	ADP
ecletica-1369	110	3	the	the	DET
ecletica-1369	110	4	energy	energy	NOUN
ecletica-1369	110	5	levels	level	NOUN
ecletica-1369	110	6	of	of	ADP
ecletica-1369	110	7	oligomers	oligomer	NOUN
ecletica-1369	110	8	(	(	PUNCT
ecletica-1369	110	9	d	d	NOUN
ecletica-1369	110	10	)	)	PUNCT
ecletica-1369	110	11	relative	relative	ADJ
ecletica-1369	110	12	to	to	ADP
ecletica-1369	110	13	oligomer	oligomer	ADJ
ecletica-1369	110	14	a	a	DET
ecletica-1369	110	15	(	(	PUNCT
ecletica-1369	110	16	bis	bis	ADJ
ecletica-1369	110	17	-	-	ADJ
ecletica-1369	110	18	pcbm	pcbm	ADJ
ecletica-1369	110	19	)	)	PUNCT
ecletica-1369	110	20	studied	study	VERB
ecletica-1369	110	21	at	at	ADP
ecletica-1369	110	22	the	the	DET
ecletica-1369	110	23	b3lyp	b3lyp	NUM
ecletica-1369	110	24	level	level	NOUN
ecletica-1369	110	25	.	.	PUNCT
ecletica-1369	111	1	the	the	DET
ecletica-1369	111	2	homo	homo	NOUN
ecletica-1369	111	3	energy	energy	NOUN
ecletica-1369	111	4	of	of	ADP
ecletica-1369	111	5	crv	crv	PROPN
ecletica-1369	111	6	-	-	PUNCT
ecletica-1369	111	7	bbt	bbt	PROPN
ecletica-1369	111	8	is	be	AUX
ecletica-1369	111	9	high	high	ADJ
ecletica-1369	111	10	compared	compare	VERB
ecletica-1369	111	11	to	to	ADP
ecletica-1369	111	12	the	the	DET
ecletica-1369	111	13	other	other	ADJ
ecletica-1369	111	14	oligomers	oligomer	NOUN
ecletica-1369	111	15	,	,	PUNCT
ecletica-1369	111	16	with	with	ADP
ecletica-1369	111	17	the	the	DET
ecletica-1369	111	18	lowest	low	ADJ
ecletica-1369	111	19	band	band	NOUN
ecletica-1369	111	20	gap	gap	NOUN
ecletica-1369	111	21	energy	energy	NOUN
ecletica-1369	111	22	indicating	indicate	VERB
ecletica-1369	111	23	that	that	SCONJ
ecletica-1369	111	24	the	the	DET
ecletica-1369	111	25	bbt	bbt	PROPN
ecletica-1369	111	26	groups	group	NOUN
ecletica-1369	111	27	in	in	ADP
ecletica-1369	111	28	this	this	DET
ecletica-1369	111	29	molecule	molecule	NOUN
ecletica-1369	111	30	have	have	AUX
ecletica-1369	111	31	significantly	significantly	ADV
ecletica-1369	111	32	improved	improve	VERB
ecletica-1369	111	33	the	the	DET
ecletica-1369	111	34	properties	property	NOUN
ecletica-1369	111	35	of	of	ADP
ecletica-1369	111	36	the	the	DET
ecletica-1369	111	37	hole	hole	NOUN
ecletica-1369	111	38	carrier	carrier	NOUN
ecletica-1369	111	39	,	,	PUNCT
ecletica-1369	111	40	thus	thus	ADV
ecletica-1369	111	41	the	the	DET
ecletica-1369	111	42	better	well	ADJ
ecletica-1369	111	43	stability	stability	NOUN
ecletica-1369	111	44	of	of	ADP
ecletica-1369	111	45	the	the	DET
ecletica-1369	111	46	lumo	lumo	NOUN
ecletica-1369	111	47	level	level	NOUN
ecletica-1369	111	48	gives	give	VERB
ecletica-1369	111	49	this	this	DET
ecletica-1369	111	50	oligomer	oligomer	NOUN
ecletica-1369	111	51	a	a	DET
ecletica-1369	111	52	lower	low	ADJ
ecletica-1369	111	53	homo	homo	NOUN
ecletica-1369	111	54	-	-	PUNCT
ecletica-1369	111	55	lumo	lumo	NOUN
ecletica-1369	111	56	gap	gap	NOUN
ecletica-1369	111	57	.	.	PUNCT
ecletica-1369	112	1	as	as	ADP
ecletica-1369	112	2	a	a	DET
ecletica-1369	112	3	result	result	NOUN
ecletica-1369	112	4	,	,	PUNCT
ecletica-1369	112	5	there	there	PRON
ecletica-1369	112	6	should	should	AUX
ecletica-1369	112	7	be	be	AUX
ecletica-1369	112	8	higher	high	ADJ
ecletica-1369	112	9	carrier	carrier	NOUN
ecletica-1369	112	10	mobility	mobility	NOUN
ecletica-1369	112	11	and	and	CCONJ
ecletica-1369	112	12	low	low	ADJ
ecletica-1369	112	13	kinetic	kinetic	ADJ
ecletica-1369	112	14	stability	stability	NOUN
ecletica-1369	112	15	.	.	PUNCT
ecletica-1369	113	1	as	as	ADV
ecletica-1369	113	2	well	well	ADV
ecletica-1369	113	3	as	as	ADP
ecletica-1369	113	4	the	the	DET
ecletica-1369	113	5	hole	hole	NOUN
ecletica-1369	113	6	acceptor	acceptor	NOUN
ecletica-1369	113	7	character	character	NOUN
ecletica-1369	113	8	accompanied	accompany	VERB
ecletica-1369	113	9	by	by	ADP
ecletica-1369	113	10	the	the	DET
ecletica-1369	113	11	decrease	decrease	NOUN
ecletica-1369	113	12	of	of	ADP
ecletica-1369	113	13	the	the	DET
ecletica-1369	113	14	ionization	ionization	NOUN
ecletica-1369	113	15	potential	potential	NOUN
ecletica-1369	113	16	(	(	PUNCT
ecletica-1369	113	17	ip	ip	NOUN
ecletica-1369	113	18	)	)	PUNCT
ecletica-1369	113	19	increases	increase	NOUN
ecletica-1369	113	20	.	.	PUNCT
ecletica-1369	114	1	this	this	DET
ecletica-1369	114	2	phenomenon	phenomenon	NOUN
ecletica-1369	114	3	is	be	AUX
ecletica-1369	114	4	accompanied	accompany	VERB
ecletica-1369	114	5	by	by	ADP
ecletica-1369	114	6	an	an	DET
ecletica-1369	114	7	increase	increase	NOUN
ecletica-1369	114	8	in	in	ADP
ecletica-1369	114	9	the	the	DET
ecletica-1369	114	10	conjugation	conjugation	NOUN
ecletica-1369	114	11	length	length	NOUN
ecletica-1369	114	12	and	and	CCONJ
ecletica-1369	114	13	the	the	DET
ecletica-1369	114	14	flatness	flatness	NOUN
ecletica-1369	114	15	of	of	ADP
ecletica-1369	114	16	the	the	DET
ecletica-1369	114	17	structure	structure	NOUN
ecletica-1369	114	18	.	.	PUNCT
ecletica-1369	115	1	these	these	DET
ecletica-1369	115	2	findings	finding	NOUN
ecletica-1369	115	3	are	be	AUX
ecletica-1369	115	4	confirmed	confirm	VERB
ecletica-1369	115	5	by	by	ADP
ecletica-1369	115	6	the	the	DET
ecletica-1369	115	7	structural	structural	ADJ
ecletica-1369	115	8	parameters	parameter	NOUN
ecletica-1369	115	9	(	(	PUNCT
ecletica-1369	115	10	figs	fig	NOUN
ecletica-1369	115	11	.	.	X
ecletica-1369	115	12	5	5	NUM
ecletica-1369	115	13	and	and	CCONJ
ecletica-1369	115	14	6	6	NUM
ecletica-1369	115	15	)	)	PUNCT
ecletica-1369	115	16	.	.	PUNCT
ecletica-1369	116	1	3.4	3.4	NUM
ecletica-1369	116	2	reorganization	reorganization	NOUN
ecletica-1369	116	3	energy	energy	NOUN
ecletica-1369	116	4	in	in	ADP
ecletica-1369	116	5	general	general	ADJ
ecletica-1369	116	6	,	,	PUNCT
ecletica-1369	116	7	conjugated	conjugate	VERB
ecletica-1369	116	8	organic	organic	ADJ
ecletica-1369	116	9	oligomers	oligomer	NOUN
ecletica-1369	116	10	and	and	CCONJ
ecletica-1369	116	11	polymers	polymer	NOUN
ecletica-1369	116	12	undergo	undergo	VERB
ecletica-1369	116	13	charge	charge	NOUN
ecletica-1369	116	14	transfer	transfer	NOUN
ecletica-1369	116	15	phenomena	phenomenon	NOUN
ecletica-1369	116	16	via	via	ADP
ecletica-1369	116	17	a	a	DET
ecletica-1369	116	18	jump	jump	NOUN
ecletica-1369	116	19	-	-	PUNCT
ecletica-1369	116	20	type	type	NOUN
ecletica-1369	116	21	mechanism	mechanism	NOUN
ecletica-1369	116	22	.	.	PUNCT
ecletica-1369	117	1	however	however	ADV
ecletica-1369	117	2	,	,	PUNCT
ecletica-1369	117	3	organic	organic	ADJ
ecletica-1369	117	4	oligomers	oligomer	NOUN
ecletica-1369	117	5	are	be	AUX
ecletica-1369	117	6	mainly	mainly	ADV
ecletica-1369	117	7	p	p	NOUN
ecletica-1369	117	8	-	-	PUNCT
ecletica-1369	117	9	type	type	NOUN
ecletica-1369	117	10	.	.	PUNCT
ecletica-1369	118	1	therefore	therefore	ADV
ecletica-1369	118	2	,	,	PUNCT
ecletica-1369	118	3	in	in	ADP
ecletica-1369	118	4	this	this	DET
ecletica-1369	118	5	case	case	NOUN
ecletica-1369	118	6	,	,	PUNCT
ecletica-1369	118	7	the	the	DET
ecletica-1369	118	8	charge	charge	NOUN
ecletica-1369	118	9	transfer	transfer	NOUN
ecletica-1369	118	10	process	process	NOUN
ecletica-1369	118	11	is	be	AUX
ecletica-1369	118	12	essentially	essentially	ADV
ecletica-1369	118	13	a	a	DET
ecletica-1369	118	14	hole	hole	NOUN
ecletica-1369	118	15	transfer	transfer	NOUN
ecletica-1369	118	16	process	process	NOUN
ecletica-1369	118	17	.	.	PUNCT
ecletica-1369	119	1	the	the	DET
ecletica-1369	119	2	hole	hole	NOUN
ecletica-1369	119	3	transport	transport	NOUN
ecletica-1369	119	4	in	in	ADP
ecletica-1369	119	5	organic	organic	ADJ
ecletica-1369	119	6	semiconductor	semiconductor	NOUN
ecletica-1369	119	7	materials	material	NOUN
ecletica-1369	119	8	between	between	ADP
ecletica-1369	119	9	adjacent	adjacent	ADJ
ecletica-1369	119	10	molecules	molecule	NOUN
ecletica-1369	119	11	depended	depend	VERB
ecletica-1369	119	12	on	on	ADP
ecletica-1369	119	13	the	the	DET
ecletica-1369	119	14	reorganization	reorganization	NOUN
ecletica-1369	119	15	energy	energy	NOUN
ecletica-1369	119	16	.	.	PUNCT
ecletica-1369	120	1	the	the	DET
ecletica-1369	120	2	rate	rate	NOUN
ecletica-1369	120	3	of	of	ADP
ecletica-1369	120	4	hole	hole	NOUN
ecletica-1369	120	5	transfer	transfer	NOUN
ecletica-1369	120	6	mainly	mainly	ADV
ecletica-1369	120	7	depends	depend	VERB
ecletica-1369	120	8	on	on	ADP
ecletica-1369	120	9	the	the	DET
ecletica-1369	120	10	reorganization	reorganization	NOUN
ecletica-1369	120	11	energy	energy	NOUN
ecletica-1369	120	12	(	(	PUNCT
ecletica-1369	120	13	λ	λ	NOUN
ecletica-1369	120	14	)	)	PUNCT
ecletica-1369	120	15	due	due	ADP
ecletica-1369	120	16	to	to	ADP
ecletica-1369	120	17	the	the	DET
ecletica-1369	120	18	geometric	geometric	ADJ
ecletica-1369	120	19	relaxation	relaxation	NOUN
ecletica-1369	120	20	accompanying	accompany	VERB
ecletica-1369	120	21	the	the	DET
ecletica-1369	120	22	charge	charge	NOUN
ecletica-1369	120	23	transfer	transfer	NOUN
ecletica-1369	120	24	and	and	CCONJ
ecletica-1369	120	25	the	the	DET
ecletica-1369	120	26	electronic	electronic	ADJ
ecletica-1369	120	27	coupling	coupling	NOUN
ecletica-1369	120	28	matrix	matrix	NOUN
ecletica-1369	120	29	element	element	NOUN
ecletica-1369	120	30	(	(	PUNCT
ecletica-1369	120	31	v	v	NOUN
ecletica-1369	120	32	)	)	PUNCT
ecletica-1369	120	33	between	between	ADP
ecletica-1369	120	34	the	the	DET
ecletica-1369	120	35	two	two	NUM
ecletica-1369	120	36	d	d	NOUN
ecletica-1369	120	37	-	-	PUNCT
ecletica-1369	120	38	a	a	DET
ecletica-1369	120	39	semiconductors	semiconductor	NOUN
ecletica-1369	120	40	.	.	PUNCT
ecletica-1369	121	1	however	however	ADV
ecletica-1369	121	2	,	,	PUNCT
ecletica-1369	121	3	v	v	NOUN
ecletica-1369	121	4	is	be	AUX
ecletica-1369	121	5	related	relate	VERB
ecletica-1369	121	6	to	to	ADP
ecletica-1369	121	7	the	the	DET
ecletica-1369	121	8	bandwidth	bandwidth	NOUN
ecletica-1369	121	9	in	in	ADP
ecletica-1369	121	10	conventional	conventional	ADJ
ecletica-1369	121	11	solid	solid	ADJ
ecletica-1369	121	12	-	-	PUNCT
ecletica-1369	121	13	state	state	NOUN
ecletica-1369	121	14	descriptions	description	NOUN
ecletica-1369	121	15	(	(	PUNCT
ecletica-1369	121	16	camara	camara	X
ecletica-1369	121	17	,	,	PUNCT
ecletica-1369	121	18	2011	2011	NUM
ecletica-1369	121	19	;	;	PUNCT
ecletica-1369	121	20	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	121	21	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	VERB
ecletica-1369	121	22	original	original	ADJ
ecletica-1369	121	23	article	article	NOUN
ecletica-1369	121	24	revista.iq.unesp.br	revista.iq.unesp.br	PUNCT
ecletica-1369	121	25	63	63	NUM
ecletica-1369	121	26	eclética	eclética	PROPN
ecletica-1369	121	27	química	química	PROPN
ecletica-1369	121	28	journal	journal	PROPN
ecletica-1369	121	29	,	,	PUNCT
ecletica-1369	121	30	vol	vol	NOUN
ecletica-1369	121	31	.	.	PROPN
ecletica-1369	121	32	47	47	NUM
ecletica-1369	121	33	,	,	PUNCT
ecletica-1369	121	34	n.	n.	NOUN
ecletica-1369	121	35	4	4	NUM
ecletica-1369	121	36	,	,	PUNCT
ecletica-1369	121	37	2022	2022	NUM
ecletica-1369	121	38	,	,	PUNCT
ecletica-1369	121	39	55	55	NUM
ecletica-1369	121	40	-	-	SYM
ecletica-1369	121	41	68	68	NUM
ecletica-1369	121	42	issn	issn	NOUN
ecletica-1369	121	43	:	:	PUNCT
ecletica-1369	121	44	1678	1678	NUM
ecletica-1369	121	45	-	-	SYM
ecletica-1369	121	46	4618	4618	NUM
ecletica-1369	121	47	doi	doi	NOUN
ecletica-1369	121	48	:	:	PUNCT
ecletica-1369	121	49	10.26850/1678	10.26850/1678	NUM
ecletica-1369	121	50	-	-	SYM
ecletica-1369	121	51	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	121	52	-	-	PUNCT
ecletica-1369	121	53	68	68	NUM
ecletica-1369	121	54	khoudir	khoudir	NOUN
ecletica-1369	121	55	et	et	PROPN
ecletica-1369	121	56	al	al	PROPN
ecletica-1369	121	57	.	.	PROPN
ecletica-1369	121	58	,	,	PUNCT
ecletica-1369	121	59	2000	2000	NUM
ecletica-1369	121	60	;	;	PUNCT
ecletica-1369	121	61	koh	koh	PROPN
ecletica-1369	121	62	et	et	PROPN
ecletica-1369	121	63	al	al	PROPN
ecletica-1369	121	64	.	.	PROPN
ecletica-1369	121	65	,	,	PUNCT
ecletica-1369	121	66	2008	2008	NUM
ecletica-1369	121	67	;	;	PUNCT
ecletica-1369	121	68	liu	liu	PROPN
ecletica-1369	121	69	et	et	PROPN
ecletica-1369	121	70	al	al	PROPN
ecletica-1369	121	71	.	.	PROPN
ecletica-1369	121	72	,	,	PUNCT
ecletica-1369	121	73	2019	2019	NUM
ecletica-1369	121	74	;	;	PUNCT
ecletica-1369	121	75	provencher	provencher	PROPN
ecletica-1369	121	76	et	et	PROPN
ecletica-1369	121	77	al	al	PROPN
ecletica-1369	121	78	.	.	PROPN
ecletica-1369	121	79	,	,	PUNCT
ecletica-1369	121	80	2014	2014	NUM
ecletica-1369	121	81	)	)	PUNCT
ecletica-1369	121	82	.	.	PUNCT
ecletica-1369	122	1	the	the	DET
ecletica-1369	122	2	hole	hole	NOUN
ecletica-1369	122	3	/	/	SYM
ecletica-1369	122	4	electron	electron	NOUN
ecletica-1369	122	5	transfer	transfer	NOUN
ecletica-1369	122	6	rate	rate	NOUN
ecletica-1369	122	7	for	for	ADP
ecletica-1369	122	8	higher	high	ADJ
ecletica-1369	122	9	temperature	temperature	NOUN
ecletica-1369	122	10	mainly	mainly	ADV
ecletica-1369	122	11	depends	depend	VERB
ecletica-1369	122	12	on	on	ADP
ecletica-1369	122	13	the	the	DET
ecletica-1369	122	14	reorganization	reorganization	NOUN
ecletica-1369	122	15	energy	energy	NOUN
ecletica-1369	122	16	(	(	PUNCT
ecletica-1369	122	17	λ	λ	NOUN
ecletica-1369	122	18	)	)	PUNCT
ecletica-1369	122	19	due	due	ADP
ecletica-1369	122	20	to	to	ADP
ecletica-1369	122	21	geometric	geometric	ADJ
ecletica-1369	122	22	relaxation	relaxation	NOUN
ecletica-1369	122	23	(	(	PUNCT
ecletica-1369	122	24	camara	camara	X
ecletica-1369	122	25	,	,	PUNCT
ecletica-1369	122	26	2011	2011	NUM
ecletica-1369	122	27	)	)	PUNCT
ecletica-1369	122	28	.	.	PUNCT
ecletica-1369	123	1	the	the	DET
ecletica-1369	123	2	importance	importance	NOUN
ecletica-1369	123	3	of	of	ADP
ecletica-1369	123	4	λ	λ	PROPN
ecletica-1369	123	5	in	in	ADP
ecletica-1369	123	6	charge	charge	NOUN
ecletica-1369	123	7	transfer	transfer	NOUN
ecletica-1369	123	8	processes	process	NOUN
ecletica-1369	123	9	has	have	AUX
ecletica-1369	123	10	been	be	AUX
ecletica-1369	123	11	widely	widely	ADV
ecletica-1369	123	12	studied	study	VERB
ecletica-1369	123	13	in	in	ADP
ecletica-1369	123	14	the	the	DET
ecletica-1369	123	15	context	context	NOUN
ecletica-1369	123	16	of	of	ADP
ecletica-1369	123	17	marcus	marcus	PROPN
ecletica-1369	123	18	et	et	PROPN
ecletica-1369	123	19	al	al	PROPN
ecletica-1369	123	20	.	.	PROPN
ecletica-1369	124	1	(	(	PUNCT
ecletica-1369	124	2	1989	1989	NUM
ecletica-1369	124	3	)	)	PUNCT
ecletica-1369	124	4	and	and	CCONJ
ecletica-1369	124	5	baran	baran	NOUN
ecletica-1369	124	6	et	et	PROPN
ecletica-1369	124	7	al	al	PROPN
ecletica-1369	124	8	.	.	PROPN
ecletica-1369	125	1	(	(	PUNCT
ecletica-1369	125	2	2017	2017	NUM
ecletica-1369	125	3	)	)	PUNCT
ecletica-1369	125	4	theories	theory	NOUN
ecletica-1369	125	5	.	.	PUNCT
ecletica-1369	126	1	some	some	DET
ecletica-1369	126	2	reorganization	reorganization	NOUN
ecletica-1369	126	3	energy	energy	NOUN
ecletica-1369	126	4	studies	study	NOUN
ecletica-1369	126	5	have	have	AUX
ecletica-1369	126	6	been	be	AUX
ecletica-1369	126	7	performed	perform	VERB
ecletica-1369	126	8	on	on	ADP
ecletica-1369	126	9	isolated	isolated	ADJ
ecletica-1369	126	10	molecules	molecule	NOUN
ecletica-1369	126	11	(	(	PUNCT
ecletica-1369	126	12	khoudir	khoudir	NOUN
ecletica-1369	126	13	et	et	NOUN
ecletica-1369	126	14	al	al	PROPN
ecletica-1369	126	15	.	.	PROPN
ecletica-1369	126	16	,	,	PUNCT
ecletica-1369	126	17	2000	2000	NUM
ecletica-1369	126	18	;	;	PUNCT
ecletica-1369	126	19	marcus	marcus	PROPN
ecletica-1369	126	20	et	et	PROPN
ecletica-1369	126	21	al	al	PROPN
ecletica-1369	126	22	.	.	PROPN
ecletica-1369	126	23	,	,	PUNCT
ecletica-1369	126	24	1989	1989	NUM
ecletica-1369	126	25	)	)	PUNCT
ecletica-1369	126	26	.	.	PUNCT
ecletica-1369	127	1	the	the	DET
ecletica-1369	127	2	reorganization	reorganization	NOUN
ecletica-1369	127	3	energy	energy	NOUN
ecletica-1369	127	4	is	be	AUX
ecletica-1369	127	5	usually	usually	ADV
ecletica-1369	127	6	expressed	express	VERB
ecletica-1369	127	7	as	as	ADP
ecletica-1369	127	8	the	the	DET
ecletica-1369	127	9	sum	sum	NOUN
ecletica-1369	127	10	of	of	ADP
ecletica-1369	127	11	the	the	DET
ecletica-1369	127	12	internal	internal	ADJ
ecletica-1369	127	13	and	and	CCONJ
ecletica-1369	127	14	external	external	ADJ
ecletica-1369	127	15	contributions	contribution	NOUN
ecletica-1369	127	16	.	.	PUNCT
ecletica-1369	128	1	the	the	DET
ecletica-1369	128	2	internal	internal	ADJ
ecletica-1369	128	3	contribution	contribution	NOUN
ecletica-1369	128	4	consists	consist	VERB
ecletica-1369	128	5	of	of	ADP
ecletica-1369	128	6	two	two	NUM
ecletica-1369	128	7	terms	term	NOUN
ecletica-1369	128	8	related	relate	VERB
ecletica-1369	128	9	to	to	ADP
ecletica-1369	128	10	the	the	DET
ecletica-1369	128	11	relaxation	relaxation	NOUN
ecletica-1369	128	12	of	of	ADP
ecletica-1369	128	13	the	the	DET
ecletica-1369	128	14	geometry	geometry	NOUN
ecletica-1369	128	15	from	from	ADP
ecletica-1369	128	16	the	the	DET
ecletica-1369	128	17	neutral	neutral	ADJ
ecletica-1369	128	18	to	to	ADP
ecletica-1369	128	19	the	the	DET
ecletica-1369	128	20	charged	charge	VERB
ecletica-1369	128	21	state	state	NOUN
ecletica-1369	128	22	and	and	CCONJ
ecletica-1369	128	23	from	from	ADP
ecletica-1369	128	24	the	the	DET
ecletica-1369	128	25	charged	charge	VERB
ecletica-1369	128	26	to	to	ADP
ecletica-1369	128	27	the	the	DET
ecletica-1369	128	28	neutral	neutral	ADJ
ecletica-1369	128	29	state	state	NOUN
ecletica-1369	128	30	(	(	PUNCT
ecletica-1369	128	31	liu	liu	PROPN
ecletica-1369	128	32	et	et	PROPN
ecletica-1369	128	33	al	al	PROPN
ecletica-1369	128	34	.	.	PROPN
ecletica-1369	128	35	,	,	PUNCT
ecletica-1369	128	36	2019	2019	NUM
ecletica-1369	128	37	)	)	PUNCT
ecletica-1369	128	38	.	.	PUNCT
ecletica-1369	129	1	on	on	ADP
ecletica-1369	129	2	the	the	DET
ecletica-1369	129	3	other	other	ADJ
ecletica-1369	129	4	hand	hand	NOUN
ecletica-1369	129	5	,	,	PUNCT
ecletica-1369	129	6	the	the	DET
ecletica-1369	129	7	external	external	ADJ
ecletica-1369	129	8	reorganization	reorganization	NOUN
ecletica-1369	129	9	energy	energy	NOUN
ecletica-1369	129	10	represents	represent	VERB
ecletica-1369	129	11	the	the	DET
ecletica-1369	129	12	effect	effect	NOUN
ecletica-1369	129	13	of	of	ADP
ecletica-1369	129	14	the	the	DET
ecletica-1369	129	15	external	external	ADJ
ecletica-1369	129	16	environment	environment	NOUN
ecletica-1369	129	17	on	on	ADP
ecletica-1369	129	18	the	the	DET
ecletica-1369	129	19	charge	charge	NOUN
ecletica-1369	129	20	transfer	transfer	NOUN
ecletica-1369	129	21	.	.	PUNCT
ecletica-1369	130	1	the	the	DET
ecletica-1369	130	2	calculated	calculated	ADJ
ecletica-1369	130	3	values	value	NOUN
ecletica-1369	130	4	of	of	ADP
ecletica-1369	130	5	the	the	DET
ecletica-1369	130	6	external	external	ADJ
ecletica-1369	130	7	reorganization	reorganization	NOUN
ecletica-1369	130	8	in	in	ADP
ecletica-1369	130	9	pure	pure	ADJ
ecletica-1369	130	10	organic	organic	ADJ
ecletica-1369	130	11	phases	phase	NOUN
ecletica-1369	130	12	are	be	AUX
ecletica-1369	130	13	negligible	negligible	ADJ
ecletica-1369	130	14	in	in	ADP
ecletica-1369	130	15	front	front	NOUN
ecletica-1369	130	16	of	of	ADP
ecletica-1369	130	17	the	the	DET
ecletica-1369	130	18	internal	internal	ADJ
ecletica-1369	130	19	reorganization	reorganization	NOUN
ecletica-1369	130	20	energy	energy	NOUN
ecletica-1369	130	21	values	value	NOUN
ecletica-1369	130	22	(	(	PUNCT
ecletica-1369	130	23	camara	camara	X
ecletica-1369	130	24	,	,	PUNCT
ecletica-1369	130	25	2011	2011	NUM
ecletica-1369	130	26	)	)	PUNCT
ecletica-1369	130	27	.	.	PUNCT
ecletica-1369	131	1	therefore	therefore	ADV
ecletica-1369	131	2	,	,	PUNCT
ecletica-1369	131	3	an	an	DET
ecletica-1369	131	4	estimate	estimate	NOUN
ecletica-1369	131	5	of	of	ADP
ecletica-1369	131	6	the	the	DET
ecletica-1369	131	7	internal	internal	ADJ
ecletica-1369	131	8	reorganization	reorganization	NOUN
ecletica-1369	131	9	energy	energy	NOUN
ecletica-1369	131	10	can	can	AUX
ecletica-1369	131	11	give	give	VERB
ecletica-1369	131	12	accurate	accurate	ADJ
ecletica-1369	131	13	and	and	CCONJ
ecletica-1369	131	14	important	important	ADJ
ecletica-1369	131	15	information	information	NOUN
ecletica-1369	131	16	about	about	ADP
ecletica-1369	131	17	the	the	DET
ecletica-1369	131	18	charge	charge	NOUN
ecletica-1369	131	19	mobility	mobility	NOUN
ecletica-1369	131	20	in	in	ADP
ecletica-1369	131	21	organic	organic	ADJ
ecletica-1369	131	22	semiconductor	semiconductor	NOUN
ecletica-1369	131	23	materials	material	NOUN
ecletica-1369	131	24	(	(	PUNCT
ecletica-1369	131	25	koh	koh	PROPN
ecletica-1369	131	26	et	et	PROPN
ecletica-1369	131	27	al	al	PROPN
ecletica-1369	131	28	.	.	PROPN
ecletica-1369	131	29	,	,	PUNCT
ecletica-1369	131	30	2008	2008	NUM
ecletica-1369	131	31	)	)	PUNCT
ecletica-1369	131	32	.	.	PUNCT
ecletica-1369	132	1	internal	internal	ADJ
ecletica-1369	132	2	reorganization	reorganization	NOUN
ecletica-1369	132	3	energies	energy	NOUN
ecletica-1369	132	4	for	for	ADP
ecletica-1369	132	5	hole	hole	NOUN
ecletica-1369	132	6	(	(	PUNCT
ecletica-1369	132	7	λ+	λ+	X
ecletica-1369	132	8	)	)	PUNCT
ecletica-1369	132	9	and	and	CCONJ
ecletica-1369	132	10	electron	electron	NOUN
ecletica-1369	132	11	(	(	PUNCT
ecletica-1369	132	12	λ	λ	NOUN
ecletica-1369	132	13	–	–	PUNCT
ecletica-1369	132	14	)	)	PUNCT
ecletica-1369	132	15	transfer	transfer	NOUN
ecletica-1369	132	16	,	,	PUNCT
ecletica-1369	132	17	adiabatic	adiabatic	ADJ
ecletica-1369	132	18	electron	electron	NOUN
ecletica-1369	132	19	affinity	affinity	NOUN
ecletica-1369	132	20	,	,	PUNCT
ecletica-1369	132	21	and	and	CCONJ
ecletica-1369	132	22	potential	potential	NOUN
ecletica-1369	132	23	are	be	AUX
ecletica-1369	132	24	also	also	ADV
ecletica-1369	132	25	discussed	discuss	VERB
ecletica-1369	132	26	.	.	PUNCT
ecletica-1369	133	1	the	the	DET
ecletica-1369	133	2	reorganization	reorganization	NOUN
ecletica-1369	133	3	energy	energy	NOUN
ecletica-1369	133	4	for	for	ADP
ecletica-1369	133	5	electron	electron	NOUN
ecletica-1369	133	6	(	(	PUNCT
ecletica-1369	133	7	λ	λ	NOUN
ecletica-1369	133	8	–	–	PUNCT
ecletica-1369	133	9	)	)	PUNCT
ecletica-1369	133	10	and	and	CCONJ
ecletica-1369	133	11	hole	hole	NOUN
ecletica-1369	133	12	(	(	PUNCT
ecletica-1369	133	13	λ+	λ+	NOUN
ecletica-1369	133	14	)	)	PUNCT
ecletica-1369	133	15	of	of	ADP
ecletica-1369	133	16	the	the	DET
ecletica-1369	133	17	oligomers	oligomer	NOUN
ecletica-1369	133	18	was	be	AUX
ecletica-1369	133	19	predicted	predict	VERB
ecletica-1369	133	20	from	from	ADP
ecletica-1369	133	21	energetic	energetic	ADJ
ecletica-1369	133	22	calculations	calculation	NOUN
ecletica-1369	133	23	at	at	ADP
ecletica-1369	133	24	the	the	DET
ecletica-1369	133	25	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	133	26	-	-	NOUN
ecletica-1369	133	27	31g(d	31g(d	PROPN
ecletica-1369	133	28	,	,	PUNCT
ecletica-1369	133	29	p	p	NOUN
ecletica-1369	133	30	)	)	PUNCT
ecletica-1369	133	31	level	level	NOUN
ecletica-1369	133	32	based	base	VERB
ecletica-1369	133	33	on	on	ADP
ecletica-1369	133	34	the	the	DET
ecletica-1369	133	35	optimized	optimize	VERB
ecletica-1369	133	36	neutral	neutral	ADJ
ecletica-1369	133	37	,	,	PUNCT
ecletica-1369	133	38	cationic	cationic	ADJ
ecletica-1369	133	39	,	,	PUNCT
ecletica-1369	133	40	and	and	CCONJ
ecletica-1369	133	41	anionic	anionic	ADJ
ecletica-1369	133	42	geometries	geometry	NOUN
ecletica-1369	133	43	at	at	ADP
ecletica-1369	133	44	the	the	DET
ecletica-1369	133	45	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	133	46	-	-	NOUN
ecletica-1369	133	47	31g(d	31g(d	NOUN
ecletica-1369	133	48	)	)	PUNCT
ecletica-1369	133	49	level	level	NOUN
ecletica-1369	133	50	.	.	PUNCT
ecletica-1369	134	1	thus	thus	ADV
ecletica-1369	134	2	,	,	PUNCT
ecletica-1369	134	3	the	the	DET
ecletica-1369	134	4	reorganization	reorganization	NOUN
ecletica-1369	134	5	energies	energy	NOUN
ecletica-1369	134	6	for	for	ADP
ecletica-1369	134	7	λ+	λ+	PUNCT
ecletica-1369	134	8	and	and	CCONJ
ecletica-1369	134	9	λ	λ	NOUN
ecletica-1369	134	10	–	–	PUNCT
ecletica-1369	134	11	transfer	transfer	NOUN
ecletica-1369	134	12	are	be	AUX
ecletica-1369	134	13	determined	determine	VERB
ecletica-1369	134	14	by	by	ADP
ecletica-1369	134	15	eqs	eqs	PROPN
ecletica-1369	134	16	.	.	PROPN
ecletica-1369	134	17	1	1	NUM
ecletica-1369	134	18	and	and	CCONJ
ecletica-1369	134	19	2	2	NUM
ecletica-1369	134	20	(	(	PUNCT
ecletica-1369	134	21	berlin	berlin	PROPN
ecletica-1369	134	22	et	et	PROPN
ecletica-1369	134	23	al	al	PROPN
ecletica-1369	134	24	.	.	PROPN
ecletica-1369	134	25	,	,	PUNCT
ecletica-1369	134	26	2003	2003	NUM
ecletica-1369	134	27	;	;	PUNCT
ecletica-1369	134	28	cheung	cheung	PROPN
ecletica-1369	134	29	et	et	PROPN
ecletica-1369	134	30	al	al	PROPN
ecletica-1369	134	31	.	.	PROPN
ecletica-1369	134	32	,	,	PUNCT
ecletica-1369	134	33	2010	2010	NUM
ecletica-1369	134	34	;	;	PUNCT
ecletica-1369	134	35	sun	sun	PROPN
ecletica-1369	134	36	et	et	PROPN
ecletica-1369	134	37	al	al	PROPN
ecletica-1369	134	38	.	.	PROPN
ecletica-1369	134	39	,	,	PUNCT
ecletica-1369	134	40	2017	2017	NUM
ecletica-1369	134	41	):	):	PUNCT
ecletica-1369	134	42	λ+	λ+	X
ecletica-1369	134	43	=	=	X
ecletica-1369	135	1	[	[	X
ecletica-1369	135	2	e+	e+	X
ecletica-1369	135	3	(	(	PUNCT
ecletica-1369	135	4	m	m	NOUN
ecletica-1369	135	5	)	)	PUNCT
ecletica-1369	135	6	–	–	PUNCT
ecletica-1369	135	7	e+	e+	X
ecletica-1369	135	8	(	(	PUNCT
ecletica-1369	135	9	m+	m+	NUM
ecletica-1369	135	10	)	)	PUNCT
ecletica-1369	135	11	]	]	PUNCT
ecletica-1369	136	1	+	+	CCONJ
ecletica-1369	137	1	[	[	X
ecletica-1369	137	2	e	e	X
ecletica-1369	137	3	(	(	PUNCT
ecletica-1369	137	4	m+	m+	NUM
ecletica-1369	137	5	)	)	PUNCT
ecletica-1369	137	6	–	–	PUNCT
ecletica-1369	137	7	e	e	X
ecletica-1369	137	8	(	(	PUNCT
ecletica-1369	137	9	m	m	PROPN
ecletica-1369	137	10	)	)	PUNCT
ecletica-1369	137	11	]	]	PUNCT
ecletica-1369	137	12	=	=	SYM
ecletica-1369	137	13	ipv	ipv	X
ecletica-1369	137	14	–	–	PUNCT
ecletica-1369	137	15	hep	hep	NOUN
ecletica-1369	137	16	(	(	PUNCT
ecletica-1369	137	17	1	1	NUM
ecletica-1369	137	18	)	)	PUNCT
ecletica-1369	137	19	λ=	λ=	VERB
ecletica-1369	137	20	[	[	X
ecletica-1369	137	21	e–(m	e–(m	NOUN
ecletica-1369	137	22	)	)	PUNCT
ecletica-1369	137	23	–	–	PUNCT
ecletica-1369	137	24	e–(m	e–(m	NOUN
ecletica-1369	137	25	–	–	PUNCT
ecletica-1369	137	26	)	)	PUNCT
ecletica-1369	137	27	]	]	PUNCT
ecletica-1369	138	1	+	+	CCONJ
ecletica-1369	138	2	[	[	X
ecletica-1369	138	3	e	e	X
ecletica-1369	138	4	(	(	PUNCT
ecletica-1369	138	5	m	m	NOUN
ecletica-1369	138	6	–	–	PUNCT
ecletica-1369	138	7	)	)	PUNCT
ecletica-1369	138	8	–	–	PUNCT
ecletica-1369	138	9	e	e	X
ecletica-1369	138	10	(	(	PUNCT
ecletica-1369	138	11	m	m	PROPN
ecletica-1369	138	12	)	)	PUNCT
ecletica-1369	138	13	]	]	PUNCT
ecletica-1369	138	14	=	=	SYM
ecletica-1369	138	15	eav	eav	PROPN
ecletica-1369	138	16	–	–	PUNCT
ecletica-1369	138	17	eep	eep	NOUN
ecletica-1369	138	18	(	(	PUNCT
ecletica-1369	138	19	2	2	NUM
ecletica-1369	138	20	)	)	PUNCT
ecletica-1369	138	21	where	where	SCONJ
ecletica-1369	138	22	e	e	X
ecletica-1369	138	23	(	(	PUNCT
ecletica-1369	138	24	m	m	PROPN
ecletica-1369	138	25	)	)	PUNCT
ecletica-1369	138	26	,	,	PUNCT
ecletica-1369	138	27	e	e	X
ecletica-1369	138	28	–	–	PUNCT
ecletica-1369	138	29	(	(	PUNCT
ecletica-1369	138	30	m	m	NOUN
ecletica-1369	138	31	–	–	PUNCT
ecletica-1369	138	32	)	)	PUNCT
ecletica-1369	138	33	,	,	PUNCT
ecletica-1369	138	34	and	and	CCONJ
ecletica-1369	138	35	e+	e+	X
ecletica-1369	138	36	(	(	PUNCT
ecletica-1369	138	37	m+	m+	NUM
ecletica-1369	138	38	)	)	PUNCT
ecletica-1369	138	39	are	be	AUX
ecletica-1369	138	40	the	the	DET
ecletica-1369	138	41	energy	energy	NOUN
ecletica-1369	138	42	of	of	ADP
ecletica-1369	138	43	the	the	DET
ecletica-1369	138	44	neutral	neutral	ADJ
ecletica-1369	138	45	state	state	NOUN
ecletica-1369	138	46	,	,	PUNCT
ecletica-1369	138	47	anion	anion	NOUN
ecletica-1369	138	48	,	,	PUNCT
ecletica-1369	138	49	and	and	CCONJ
ecletica-1369	138	50	cation	cation	NOUN
ecletica-1369	138	51	in	in	ADP
ecletica-1369	138	52	their	their	PRON
ecletica-1369	138	53	optimized	optimize	VERB
ecletica-1369	138	54	structures	structure	NOUN
ecletica-1369	138	55	,	,	PUNCT
ecletica-1369	138	56	respectively	respectively	ADV
ecletica-1369	138	57	.	.	PUNCT
ecletica-1369	139	1	e+	e+	VERB
ecletica-1369	139	2	(	(	PUNCT
ecletica-1369	139	3	m)is	m)is	PROPN
ecletica-1369	139	4	the	the	DET
ecletica-1369	139	5	total	total	ADJ
ecletica-1369	139	6	energy	energy	NOUN
ecletica-1369	139	7	of	of	ADP
ecletica-1369	139	8	the	the	DET
ecletica-1369	139	9	cation	cation	NOUN
ecletica-1369	139	10	in	in	ADP
ecletica-1369	139	11	the	the	DET
ecletica-1369	139	12	neutral	neutral	ADJ
ecletica-1369	139	13	geometry	geometry	NOUN
ecletica-1369	139	14	,	,	PUNCT
ecletica-1369	139	15	e	e	X
ecletica-1369	139	16	(	(	PUNCT
ecletica-1369	139	17	m+	m+	NOUN
ecletica-1369	139	18	)	)	PUNCT
ecletica-1369	139	19	is	be	AUX
ecletica-1369	139	20	the	the	DET
ecletica-1369	139	21	total	total	ADJ
ecletica-1369	139	22	energy	energy	NOUN
ecletica-1369	139	23	of	of	ADP
ecletica-1369	139	24	the	the	DET
ecletica-1369	139	25	neutral	neutral	ADJ
ecletica-1369	139	26	state	state	NOUN
ecletica-1369	139	27	in	in	ADP
ecletica-1369	139	28	the	the	DET
ecletica-1369	139	29	cation	cation	NOUN
ecletica-1369	139	30	geometry	geometry	NOUN
ecletica-1369	139	31	,	,	PUNCT
ecletica-1369	139	32	e	e	X
ecletica-1369	139	33	–	–	PUNCT
ecletica-1369	139	34	(	(	PUNCT
ecletica-1369	139	35	m	m	NOUN
ecletica-1369	139	36	)	)	PUNCT
ecletica-1369	139	37	is	be	AUX
ecletica-1369	139	38	the	the	DET
ecletica-1369	139	39	total	total	ADJ
ecletica-1369	139	40	energy	energy	NOUN
ecletica-1369	139	41	of	of	ADP
ecletica-1369	139	42	the	the	DET
ecletica-1369	139	43	anion	anion	NOUN
ecletica-1369	139	44	in	in	ADP
ecletica-1369	139	45	the	the	DET
ecletica-1369	139	46	neutral	neutral	ADJ
ecletica-1369	139	47	geometry	geometry	NOUN
ecletica-1369	139	48	,	,	PUNCT
ecletica-1369	139	49	and	and	CCONJ
ecletica-1369	140	1	e	e	X
ecletica-1369	140	2	(	(	PUNCT
ecletica-1369	140	3	m	m	PROPN
ecletica-1369	140	4	–	–	PUNCT
ecletica-1369	140	5	)	)	PUNCT
ecletica-1369	140	6	is	be	AUX
ecletica-1369	140	7	the	the	DET
ecletica-1369	140	8	total	total	ADJ
ecletica-1369	140	9	energy	energy	NOUN
ecletica-1369	140	10	of	of	ADP
ecletica-1369	140	11	the	the	DET
ecletica-1369	140	12	neutral	neutral	ADJ
ecletica-1369	140	13	in	in	ADP
ecletica-1369	140	14	anion	anion	NOUN
ecletica-1369	140	15	geometry	geometry	NOUN
ecletica-1369	140	16	.	.	PUNCT
ecletica-1369	141	1	the	the	DET
ecletica-1369	141	2	values	value	NOUN
ecletica-1369	141	3	of	of	ADP
ecletica-1369	141	4	the	the	DET
ecletica-1369	141	5	adiabatic	adiabatic	ADJ
ecletica-1369	141	6	(	(	PUNCT
ecletica-1369	141	7	eaa	eaa	PROPN
ecletica-1369	141	8	)	)	PUNCT
ecletica-1369	141	9	and	and	CCONJ
ecletica-1369	141	10	vertical	vertical	ADJ
ecletica-1369	141	11	(	(	PUNCT
ecletica-1369	141	12	eav	eav	PROPN
ecletica-1369	141	13	)	)	PUNCT
ecletica-1369	141	14	electron	electron	NOUN
ecletica-1369	141	15	affinity	affinity	NOUN
ecletica-1369	141	16	and	and	CCONJ
ecletica-1369	141	17	the	the	DET
ecletica-1369	141	18	adiabatic	adiabatic	ADJ
ecletica-1369	141	19	(	(	PUNCT
ecletica-1369	141	20	ipa	ipa	PROPN
ecletica-1369	141	21	)	)	PUNCT
ecletica-1369	141	22	and	and	CCONJ
ecletica-1369	141	23	vertical	vertical	ADJ
ecletica-1369	141	24	(	(	PUNCT
ecletica-1369	141	25	ipv	ipv	ADJ
ecletica-1369	141	26	)	)	PUNCT
ecletica-1369	141	27	ionization	ionization	NOUN
ecletica-1369	141	28	potential	potential	NOUN
ecletica-1369	141	29	of	of	ADP
ecletica-1369	141	30	the	the	DET
ecletica-1369	141	31	molecules	molecule	NOUN
ecletica-1369	141	32	are	be	AUX
ecletica-1369	141	33	calculated	calculate	VERB
ecletica-1369	141	34	from	from	ADP
ecletica-1369	141	35	according	accord	VERB
ecletica-1369	141	36	to	to	ADP
ecletica-1369	141	37	eqs	eqs	PROPN
ecletica-1369	141	38	.	.	PUNCT
ecletica-1369	142	1	3–6	3–6	NUM
ecletica-1369	142	2	:	:	PUNCT
ecletica-1369	142	3	electronic	electronic	ADJ
ecletica-1369	142	4	affinity	affinity	NOUN
ecletica-1369	142	5	:	:	PUNCT
ecletica-1369	142	6	eaa	eaa	X
ecletica-1369	142	7	=	=	PUNCT
ecletica-1369	143	1	e	e	X
ecletica-1369	143	2	(	(	PUNCT
ecletica-1369	143	3	m	m	NOUN
ecletica-1369	143	4	)	)	PUNCT
ecletica-1369	143	5	e	e	NOUN
ecletica-1369	143	6	–	–	PUNCT
ecletica-1369	143	7	(	(	PUNCT
ecletica-1369	143	8	m	m	NOUN
ecletica-1369	143	9	–	–	PUNCT
ecletica-1369	143	10	)	)	PUNCT
ecletica-1369	143	11	(	(	PUNCT
ecletica-1369	143	12	3	3	X
ecletica-1369	143	13	)	)	PUNCT
ecletica-1369	143	14	eav	eav	NOUN
ecletica-1369	143	15	=	=	SYM
ecletica-1369	143	16	e	e	PROPN
ecletica-1369	143	17	(	(	PUNCT
ecletica-1369	143	18	m	m	NOUN
ecletica-1369	143	19	)	)	PUNCT
ecletica-1369	143	20	e	e	NOUN
ecletica-1369	143	21	–	–	PUNCT
ecletica-1369	143	22	(	(	PUNCT
ecletica-1369	143	23	m	m	NOUN
ecletica-1369	143	24	)	)	PUNCT
ecletica-1369	143	25	(	(	PUNCT
ecletica-1369	143	26	4	4	X
ecletica-1369	143	27	)	)	PUNCT
ecletica-1369	143	28	ionization	ionization	NOUN
ecletica-1369	143	29	potential	potential	NOUN
ecletica-1369	143	30	:	:	PUNCT
ecletica-1369	143	31	ipa	ipa	PROPN
ecletica-1369	143	32	=	=	PUNCT
ecletica-1369	143	33	e+	e+	X
ecletica-1369	143	34	(	(	PUNCT
ecletica-1369	143	35	m+	m+	NUM
ecletica-1369	143	36	)	)	PUNCT
ecletica-1369	143	37	e	e	NOUN
ecletica-1369	143	38	(	(	PUNCT
ecletica-1369	143	39	m	m	PROPN
ecletica-1369	143	40	)	)	PUNCT
ecletica-1369	143	41	(	(	PUNCT
ecletica-1369	143	42	5	5	X
ecletica-1369	143	43	)	)	PUNCT
ecletica-1369	143	44	ipv	ipv	PROPN
ecletica-1369	143	45	=	=	PUNCT
ecletica-1369	143	46	e+	e+	X
ecletica-1369	143	47	(	(	PUNCT
ecletica-1369	143	48	m	m	NOUN
ecletica-1369	143	49	)	)	PUNCT
ecletica-1369	143	50	e	e	NOUN
ecletica-1369	143	51	(	(	PUNCT
ecletica-1369	143	52	m	m	PROPN
ecletica-1369	143	53	)	)	PUNCT
ecletica-1369	143	54	(	(	PUNCT
ecletica-1369	143	55	6	6	X
ecletica-1369	143	56	)	)	PUNCT
ecletica-1369	143	57	the	the	DET
ecletica-1369	143	58	electron	electron	NOUN
ecletica-1369	143	59	extraction	extraction	NOUN
ecletica-1369	143	60	potential	potential	NOUN
ecletica-1369	143	61	(	(	PUNCT
ecletica-1369	143	62	eep	eep	NOUN
ecletica-1369	143	63	)	)	PUNCT
ecletica-1369	143	64	and	and	CCONJ
ecletica-1369	143	65	hole	hole	NOUN
ecletica-1369	143	66	extraction	extraction	NOUN
ecletica-1369	143	67	potential	potential	NOUN
ecletica-1369	143	68	(	(	PUNCT
ecletica-1369	143	69	hep	hep	NOUN
ecletica-1369	143	70	)	)	PUNCT
ecletica-1369	143	71	are	be	AUX
ecletica-1369	143	72	calculated	calculate	VERB
ecletica-1369	143	73	by	by	ADP
ecletica-1369	143	74	the	the	DET
ecletica-1369	143	75	eq	eq	NOUN
ecletica-1369	143	76	.	.	PROPN
ecletica-1369	143	77	7	7	NUM
ecletica-1369	143	78	and	and	CCONJ
ecletica-1369	143	79	8	8	NUM
ecletica-1369	143	80	:	:	PUNCT
ecletica-1369	143	81	eep	eep	NOUN
ecletica-1369	143	82	=	=	SYM
ecletica-1369	143	83	e	e	X
ecletica-1369	143	84	(	(	PUNCT
ecletica-1369	143	85	m	m	PROPN
ecletica-1369	143	86	–	–	PUNCT
ecletica-1369	143	87	)	)	PUNCT
ecletica-1369	143	88	–	–	PUNCT
ecletica-1369	143	89	e	e	X
ecletica-1369	143	90	–	–	PUNCT
ecletica-1369	143	91	(	(	PUNCT
ecletica-1369	143	92	m	m	NOUN
ecletica-1369	143	93	–	–	PUNCT
ecletica-1369	143	94	)	)	PUNCT
ecletica-1369	143	95	(	(	PUNCT
ecletica-1369	143	96	7	7	X
ecletica-1369	143	97	)	)	PUNCT
ecletica-1369	143	98	hep	hep	NOUN
ecletica-1369	143	99	=	=	SYM
ecletica-1369	143	100	e+	e+	X
ecletica-1369	143	101	(	(	PUNCT
ecletica-1369	143	102	m+	m+	NUM
ecletica-1369	143	103	)	)	PUNCT
ecletica-1369	143	104	–	–	PUNCT
ecletica-1369	143	105	e	e	X
ecletica-1369	143	106	(	(	PUNCT
ecletica-1369	143	107	m+	m+	NUM
ecletica-1369	143	108	)	)	PUNCT
ecletica-1369	143	109	(	(	PUNCT
ecletica-1369	143	110	8)	8)	NUM
ecletica-1369	143	111	figures	figure	NOUN
ecletica-1369	143	112	12–14	12–14	NUM
ecletica-1369	143	113	show	show	VERB
ecletica-1369	143	114	several	several	ADJ
ecletica-1369	143	115	parameters	parameter	NOUN
ecletica-1369	143	116	related	relate	VERB
ecletica-1369	143	117	to	to	ADP
ecletica-1369	143	118	the	the	DET
ecletica-1369	143	119	studied	study	VERB
ecletica-1369	143	120	oligomers	oligomer	NOUN
ecletica-1369	143	121	:	:	PUNCT
ecletica-1369	143	122	the	the	DET
ecletica-1369	143	123	adiabatic	adiabatic	ADJ
ecletica-1369	143	124	ionization	ionization	NOUN
ecletica-1369	143	125	potential	potential	NOUN
ecletica-1369	143	126	,	,	PUNCT
ecletica-1369	143	127	vertical	vertical	ADJ
ecletica-1369	143	128	ionization	ionization	NOUN
ecletica-1369	143	129	potential	potential	NOUN
ecletica-1369	143	130	and	and	CCONJ
ecletica-1369	143	131	hole	hole	NOUN
ecletica-1369	143	132	extraction	extraction	NOUN
ecletica-1369	143	133	potential	potential	NOUN
ecletica-1369	143	134	(	(	PUNCT
ecletica-1369	143	135	fig	fig	NOUN
ecletica-1369	143	136	.	.	PUNCT
ecletica-1369	143	137	12	12	NUM
ecletica-1369	143	138	)	)	PUNCT
ecletica-1369	143	139	,	,	PUNCT
ecletica-1369	143	140	adiabatic	adiabatic	ADJ
ecletica-1369	143	141	electron	electron	NOUN
ecletica-1369	143	142	affinity	affinity	NOUN
ecletica-1369	143	143	,	,	PUNCT
ecletica-1369	143	144	vertical	vertical	ADJ
ecletica-1369	143	145	electron	electron	NOUN
ecletica-1369	143	146	affinity	affinity	NOUN
ecletica-1369	143	147	and	and	CCONJ
ecletica-1369	143	148	electron	electron	NOUN
ecletica-1369	143	149	extraction	extraction	NOUN
ecletica-1369	143	150	potential	potential	NOUN
ecletica-1369	143	151	(	(	PUNCT
ecletica-1369	143	152	fig	fig	NOUN
ecletica-1369	143	153	.	.	NOUN
ecletica-1369	143	154	13	13	NUM
ecletica-1369	143	155	)	)	PUNCT
ecletica-1369	143	156	and	and	CCONJ
ecletica-1369	143	157	oligomer	oligomer	ADJ
ecletica-1369	143	158	hole	hole	NOUN
ecletica-1369	143	159	/	/	SYM
ecletica-1369	143	160	electron	electron	NOUN
ecletica-1369	143	161	reorganization	reorganization	NOUN
ecletica-1369	143	162	energy	energy	NOUN
ecletica-1369	143	163	(	(	PUNCT
ecletica-1369	143	164	fig	fig	NOUN
ecletica-1369	143	165	.	.	PUNCT
ecletica-1369	143	166	14	14	NUM
ecletica-1369	143	167	)	)	PUNCT
ecletica-1369	143	168	.	.	PUNCT
ecletica-1369	144	1	figure	figure	NOUN
ecletica-1369	144	2	12	12	NUM
ecletica-1369	144	3	.	.	PUNCT
ecletica-1369	145	1	adiabatic	adiabatic	ADJ
ecletica-1369	145	2	ionization	ionization	NOUN
ecletica-1369	145	3	potential	potential	NOUN
ecletica-1369	145	4	(	(	PUNCT
ecletica-1369	145	5	ipa	ipa	PROPN
ecletica-1369	145	6	)	)	PUNCT
ecletica-1369	145	7	,	,	PUNCT
ecletica-1369	145	8	vertical	vertical	ADJ
ecletica-1369	145	9	ionization	ionization	NOUN
ecletica-1369	145	10	potential	potential	NOUN
ecletica-1369	145	11	(	(	PUNCT
ecletica-1369	145	12	ipv	ipv	PROPN
ecletica-1369	145	13	)	)	PUNCT
ecletica-1369	145	14	,	,	PUNCT
ecletica-1369	145	15	hole	hole	NOUN
ecletica-1369	145	16	extraction	extraction	NOUN
ecletica-1369	145	17	potential	potential	NOUN
ecletica-1369	145	18	(	(	PUNCT
ecletica-1369	145	19	hep	hep	NOUN
ecletica-1369	145	20	)	)	PUNCT
ecletica-1369	145	21	of	of	ADP
ecletica-1369	145	22	oligomers	oligomer	NOUN
ecletica-1369	145	23	(	(	PUNCT
ecletica-1369	145	24	ev	ev	NOUN
ecletica-1369	145	25	)	)	PUNCT
ecletica-1369	145	26	calculated	calculate	VERB
ecletica-1369	145	27	by	by	ADP
ecletica-1369	145	28	b3lyp/631g(d	b3lyp/631g(d	PROPN
ecletica-1369	145	29	,	,	PUNCT
ecletica-1369	145	30	p	p	NOUN
ecletica-1369	145	31	)	)	PUNCT
ecletica-1369	145	32	.	.	PUNCT
ecletica-1369	146	1	figure	figure	NOUN
ecletica-1369	146	2	12	12	NUM
ecletica-1369	146	3	shows	show	VERB
ecletica-1369	146	4	the	the	DET
ecletica-1369	146	5	lowest	low	ADJ
ecletica-1369	146	6	value	value	NOUN
ecletica-1369	146	7	of	of	ADP
ecletica-1369	146	8	ionization	ionization	NOUN
ecletica-1369	146	9	potential	potential	NOUN
ecletica-1369	146	10	carried	carry	VERB
ecletica-1369	146	11	by	by	ADP
ecletica-1369	146	12	the	the	DET
ecletica-1369	146	13	crv	crv	PROPN
ecletica-1369	146	14	-	-	PUNCT
ecletica-1369	146	15	pt	pt	NOUN
ecletica-1369	146	16	molecule	molecule	NOUN
ecletica-1369	146	17	,	,	PUNCT
ecletica-1369	146	18	which	which	PRON
ecletica-1369	146	19	gives	give	VERB
ecletica-1369	146	20	this	this	DET
ecletica-1369	146	21	molecule	molecule	NOUN
ecletica-1369	146	22	the	the	DET
ecletica-1369	146	23	character	character	NOUN
ecletica-1369	146	24	of	of	ADP
ecletica-1369	146	25	an	an	DET
ecletica-1369	146	26	electron	electron	NOUN
ecletica-1369	146	27	donor	donor	NOUN
ecletica-1369	146	28	,	,	PUNCT
ecletica-1369	146	29	as	as	ADV
ecletica-1369	146	30	well	well	ADV
ecletica-1369	146	31	as	as	ADP
ecletica-1369	146	32	the	the	DET
ecletica-1369	146	33	values	value	NOUN
ecletica-1369	146	34	of	of	ADP
ecletica-1369	146	35	the	the	DET
ecletica-1369	146	36	crv	crv	PROPN
ecletica-1369	146	37	-	-	PUNCT
ecletica-1369	146	38	bbt	bbt	PROPN
ecletica-1369	146	39	molecule	molecule	NOUN
ecletica-1369	146	40	are	be	AUX
ecletica-1369	146	41	also	also	ADV
ecletica-1369	146	42	slightly	slightly	ADV
ecletica-1369	146	43	small	small	ADJ
ecletica-1369	146	44	,	,	PUNCT
ecletica-1369	146	45	i.e.	i.e.	X
ecletica-1369	146	46	,	,	PUNCT
ecletica-1369	146	47	this	this	DET
ecletica-1369	146	48	oligomer	oligomer	NOUN
ecletica-1369	146	49	has	have	VERB
ecletica-1369	146	50	an	an	DET
ecletica-1369	146	51	electron	electron	NOUN
ecletica-1369	146	52	donor	donor	NOUN
ecletica-1369	146	53	character	character	NOUN
ecletica-1369	146	54	.	.	PUNCT
ecletica-1369	147	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	147	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	PROPN
ecletica-1369	147	3	original	original	ADJ
ecletica-1369	147	4	article	article	NOUN
ecletica-1369	147	5	revista.iq.unesp.br	revista.iq.unesp.br	PUNCT
ecletica-1369	147	6	64	64	NUM
ecletica-1369	147	7	eclética	eclética	PROPN
ecletica-1369	147	8	química	química	PROPN
ecletica-1369	147	9	journal	journal	PROPN
ecletica-1369	147	10	,	,	PUNCT
ecletica-1369	147	11	vol	vol	NOUN
ecletica-1369	147	12	.	.	PROPN
ecletica-1369	147	13	47	47	NUM
ecletica-1369	147	14	,	,	PUNCT
ecletica-1369	147	15	n.	n.	NOUN
ecletica-1369	147	16	4	4	NUM
ecletica-1369	147	17	,	,	PUNCT
ecletica-1369	147	18	2022	2022	NUM
ecletica-1369	147	19	,	,	PUNCT
ecletica-1369	147	20	55	55	NUM
ecletica-1369	147	21	-	-	SYM
ecletica-1369	147	22	68	68	NUM
ecletica-1369	147	23	issn	issn	NOUN
ecletica-1369	147	24	:	:	PUNCT
ecletica-1369	147	25	1678	1678	NUM
ecletica-1369	147	26	-	-	SYM
ecletica-1369	147	27	4618	4618	NUM
ecletica-1369	147	28	doi	doi	NOUN
ecletica-1369	147	29	:	:	PUNCT
ecletica-1369	147	30	10.26850/1678	10.26850/1678	NUM
ecletica-1369	147	31	-	-	SYM
ecletica-1369	147	32	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	147	33	-	-	PUNCT
ecletica-1369	147	34	68	68	NUM
ecletica-1369	147	35	figure	figure	NOUN
ecletica-1369	147	36	13	13	NUM
ecletica-1369	147	37	.	.	PUNCT
ecletica-1369	148	1	adiabatic	adiabatic	ADJ
ecletica-1369	148	2	electron	electron	NOUN
ecletica-1369	148	3	affinity	affinity	NOUN
ecletica-1369	148	4	(	(	PUNCT
ecletica-1369	148	5	eaa	eaa	PROPN
ecletica-1369	148	6	)	)	PUNCT
ecletica-1369	148	7	,	,	PUNCT
ecletica-1369	148	8	vertical	vertical	ADJ
ecletica-1369	148	9	electron	electron	NOUN
ecletica-1369	148	10	affinity	affinity	NOUN
ecletica-1369	148	11	(	(	PUNCT
ecletica-1369	148	12	eav	eav	PROPN
ecletica-1369	148	13	)	)	PUNCT
ecletica-1369	148	14	,	,	PUNCT
ecletica-1369	148	15	electron	electron	NOUN
ecletica-1369	148	16	extraction	extraction	NOUN
ecletica-1369	148	17	potential	potential	NOUN
ecletica-1369	148	18	(	(	PUNCT
ecletica-1369	148	19	eep	eep	NOUN
ecletica-1369	148	20	)	)	PUNCT
ecletica-1369	148	21	of	of	ADP
ecletica-1369	148	22	oligomers	oligomer	NOUN
ecletica-1369	148	23	(	(	PUNCT
ecletica-1369	148	24	ev	ev	NOUN
ecletica-1369	148	25	)	)	PUNCT
ecletica-1369	148	26	calculated	calculate	VERB
ecletica-1369	148	27	by	by	ADP
ecletica-1369	148	28	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	148	29	-	-	PROPN
ecletica-1369	148	30	31	31	NUM
ecletica-1369	148	31	g	g	NOUN
ecletica-1369	148	32	(	(	PUNCT
ecletica-1369	148	33	d	d	PROPN
ecletica-1369	148	34	,	,	PUNCT
ecletica-1369	148	35	p	p	NOUN
ecletica-1369	148	36	)	)	PUNCT
ecletica-1369	148	37	.	.	PUNCT
ecletica-1369	149	1	in	in	ADP
ecletica-1369	149	2	fig	fig	NOUN
ecletica-1369	149	3	.	.	PUNCT
ecletica-1369	150	1	13	13	NUM
ecletica-1369	150	2	,	,	PUNCT
ecletica-1369	150	3	the	the	DET
ecletica-1369	150	4	higher	high	ADJ
ecletica-1369	150	5	value	value	NOUN
ecletica-1369	150	6	of	of	ADP
ecletica-1369	150	7	electron	electron	NOUN
ecletica-1369	150	8	affinity	affinity	NOUN
ecletica-1369	150	9	of	of	ADP
ecletica-1369	150	10	the	the	DET
ecletica-1369	150	11	crv	crv	PROPN
ecletica-1369	150	12	-	-	PUNCT
ecletica-1369	150	13	bbt	bbt	PROPN
ecletica-1369	150	14	molecule	molecule	NOUN
ecletica-1369	150	15	makes	make	VERB
ecletica-1369	150	16	this	this	DET
ecletica-1369	150	17	molecule	molecule	NOUN
ecletica-1369	150	18	more	more	ADV
ecletica-1369	150	19	stable	stable	ADJ
ecletica-1369	150	20	and	and	CCONJ
ecletica-1369	150	21	electron	electron	NOUN
ecletica-1369	150	22	rich	rich	ADJ
ecletica-1369	150	23	,	,	PUNCT
ecletica-1369	150	24	which	which	PRON
ecletica-1369	150	25	confirms	confirm	VERB
ecletica-1369	150	26	that	that	SCONJ
ecletica-1369	150	27	this	this	DET
ecletica-1369	150	28	molecule	molecule	NOUN
ecletica-1369	150	29	is	be	AUX
ecletica-1369	150	30	a	a	DET
ecletica-1369	150	31	strong	strong	ADJ
ecletica-1369	150	32	electron	electron	NOUN
ecletica-1369	150	33	donor	donor	NOUN
ecletica-1369	150	34	.	.	PUNCT
ecletica-1369	151	1	figure	figure	NOUN
ecletica-1369	151	2	14	14	NUM
ecletica-1369	151	3	.	.	PUNCT
ecletica-1369	152	1	oligomer	oligomer	ADJ
ecletica-1369	152	2	hole	hole	NOUN
ecletica-1369	152	3	/	/	SYM
ecletica-1369	152	4	electron	electron	NOUN
ecletica-1369	152	5	reorganization	reorganization	NOUN
ecletica-1369	152	6	energy	energy	NOUN
ecletica-1369	152	7	(	(	PUNCT
ecletica-1369	152	8	ev	ev	NOUN
ecletica-1369	152	9	)	)	PUNCT
ecletica-1369	152	10	calculated	calculate	VERB
ecletica-1369	152	11	by	by	ADP
ecletica-1369	152	12	b3lyp/6	b3lyp/6	PROPN
ecletica-1369	152	13	-	-	NOUN
ecletica-1369	152	14	31g(d	31g(d	PROPN
ecletica-1369	152	15	,	,	PUNCT
ecletica-1369	152	16	p	p	NOUN
ecletica-1369	152	17	)	)	PUNCT
ecletica-1369	152	18	.	.	PUNCT
ecletica-1369	153	1	the	the	DET
ecletica-1369	153	2	oligomer	oligomer	NOUN
ecletica-1369	153	3	with	with	ADP
ecletica-1369	153	4	the	the	DET
ecletica-1369	153	5	bbt	bbt	PROPN
ecletica-1369	153	6	moiety	moiety	PROPN
ecletica-1369	153	7	has	have	VERB
ecletica-1369	153	8	at	at	ADP
ecletica-1369	153	9	the	the	DET
ecletica-1369	153	10	lowest	low	ADJ
ecletica-1369	153	11	value	value	NOUN
ecletica-1369	153	12	of	of	ADP
ecletica-1369	153	13	λ	λ	PROPN
ecletica-1369	153	14	reorganization	reorganization	NOUN
ecletica-1369	153	15	energy	energy	NOUN
ecletica-1369	153	16	(	(	PUNCT
ecletica-1369	153	17	0.4431	0.4431	NUM
ecletica-1369	153	18	ev	ev	NUM
ecletica-1369	153	19	)	)	PUNCT
ecletica-1369	153	20	.	.	PUNCT
ecletica-1369	154	1	this	this	PRON
ecletica-1369	154	2	indicates	indicate	VERB
ecletica-1369	154	3	that	that	SCONJ
ecletica-1369	154	4	the	the	DET
ecletica-1369	154	5	transport	transport	NOUN
ecletica-1369	154	6	of	of	ADP
ecletica-1369	154	7	electrons	electron	NOUN
ecletica-1369	154	8	gives	give	VERB
ecletica-1369	154	9	the	the	DET
ecletica-1369	154	10	materials	material	NOUN
ecletica-1369	154	11	based	base	VERB
ecletica-1369	154	12	on	on	ADP
ecletica-1369	154	13	this	this	DET
ecletica-1369	154	14	compound	compound	NOUN
ecletica-1369	154	15	is	be	AUX
ecletica-1369	154	16	favored	favor	VERB
ecletica-1369	154	17	,	,	PUNCT
ecletica-1369	154	18	likewise	likewise	ADV
ecletica-1369	154	19	this	this	DET
ecletica-1369	154	20	compound	compound	NOUN
ecletica-1369	154	21	to	to	ADP
ecletica-1369	154	22	the	the	DET
ecletica-1369	154	23	greatest	great	ADJ
ecletica-1369	154	24	value	value	NOUN
ecletica-1369	154	25	of	of	ADP
ecletica-1369	154	26	eaa	eaa	PROPN
ecletica-1369	154	27	.	.	PUNCT
ecletica-1369	155	1	therefore	therefore	ADV
ecletica-1369	155	2	,	,	PUNCT
ecletica-1369	155	3	the	the	PRON
ecletica-1369	155	4	greater	great	ADJ
ecletica-1369	155	5	the	the	DET
ecletica-1369	155	6	electron	electron	NOUN
ecletica-1369	155	7	affinity	affinity	NOUN
ecletica-1369	155	8	the	the	PRON
ecletica-1369	155	9	better	well	ADJ
ecletica-1369	155	10	the	the	DET
ecletica-1369	155	11	electron	electron	NOUN
ecletica-1369	155	12	capture	capture	NOUN
ecletica-1369	155	13	ability	ability	NOUN
ecletica-1369	155	14	.	.	PUNCT
ecletica-1369	156	1	the	the	DET
ecletica-1369	156	2	ip	ip	NOUN
ecletica-1369	156	3	values	value	NOUN
ecletica-1369	156	4	for	for	ADP
ecletica-1369	156	5	the	the	DET
ecletica-1369	156	6	molecules	molecule	NOUN
ecletica-1369	156	7	with	with	ADP
ecletica-1369	156	8	r	r	NOUN
ecletica-1369	156	9	groups	group	NOUN
ecletica-1369	156	10	are	be	AUX
ecletica-1369	156	11	all	all	ADV
ecletica-1369	156	12	lower	low	ADJ
ecletica-1369	156	13	than	than	ADP
ecletica-1369	156	14	the	the	DET
ecletica-1369	156	15	value	value	NOUN
ecletica-1369	156	16	of	of	ADP
ecletica-1369	156	17	the	the	DET
ecletica-1369	156	18	crv	crv	PROPN
ecletica-1369	156	19	-	-	PUNCT
ecletica-1369	156	20	h	h	NOUN
ecletica-1369	156	21	oligomer	oligomer	NOUN
ecletica-1369	156	22	,	,	PUNCT
ecletica-1369	156	23	which	which	PRON
ecletica-1369	156	24	can	can	AUX
ecletica-1369	156	25	be	be	AUX
ecletica-1369	156	26	attributed	attribute	VERB
ecletica-1369	156	27	to	to	ADP
ecletica-1369	156	28	the	the	DET
ecletica-1369	156	29	inductive	inductive	ADJ
ecletica-1369	156	30	and	and	CCONJ
ecletica-1369	156	31	negative	negative	ADJ
ecletica-1369	156	32	resonance	resonance	NOUN
ecletica-1369	156	33	effects	effect	NOUN
ecletica-1369	156	34	of	of	ADP
ecletica-1369	156	35	r	r	NOUN
ecletica-1369	156	36	groups	group	NOUN
ecletica-1369	156	37	.	.	PUNCT
ecletica-1369	157	1	from	from	ADP
ecletica-1369	157	2	the	the	DET
ecletica-1369	157	3	values	value	NOUN
ecletica-1369	157	4	of	of	ADP
ecletica-1369	157	5	ea	ea	NOUN
ecletica-1369	157	6	and	and	CCONJ
ecletica-1369	157	7	ip	ip	NOUN
ecletica-1369	157	8	,	,	PUNCT
ecletica-1369	157	9	it	it	PRON
ecletica-1369	157	10	is	be	AUX
ecletica-1369	157	11	believed	believe	VERB
ecletica-1369	157	12	that	that	SCONJ
ecletica-1369	157	13	the	the	DET
ecletica-1369	157	14	systems	system	NOUN
ecletica-1369	157	15	with	with	ADP
ecletica-1369	157	16	r	r	NOUN
ecletica-1369	157	17	groups	group	NOUN
ecletica-1369	157	18	can	can	AUX
ecletica-1369	157	19	be	be	AUX
ecletica-1369	157	20	used	use	VERB
ecletica-1369	157	21	as	as	ADP
ecletica-1369	157	22	a	a	DET
ecletica-1369	157	23	better	well	ADJ
ecletica-1369	157	24	organic	organic	ADJ
ecletica-1369	157	25	semiconductor	semiconductor	NOUN
ecletica-1369	157	26	material	material	NOUN
ecletica-1369	157	27	,	,	PUNCT
ecletica-1369	157	28	for	for	ADP
ecletica-1369	157	29	d	d	PROPN
ecletica-1369	157	30	-	-	PUNCT
ecletica-1369	157	31	π	π	NOUN
ecletica-1369	157	32	-	-	PUNCT
ecletica-1369	157	33	a	a	PRON
ecletica-1369	157	34	-	-	PUNCT
ecletica-1369	157	35	a	a	DET
ecletica-1369	157	36	type	type	NOUN
ecletica-1369	157	37	devices	device	NOUN
ecletica-1369	157	38	.	.	PUNCT
ecletica-1369	158	1	as	as	SCONJ
ecletica-1369	158	2	shown	show	VERB
ecletica-1369	158	3	in	in	ADP
ecletica-1369	158	4	fig	fig	NOUN
ecletica-1369	158	5	.	.	PUNCT
ecletica-1369	159	1	14	14	NUM
ecletica-1369	159	2	,	,	PUNCT
ecletica-1369	159	3	the	the	DET
ecletica-1369	159	4	λ+	λ+	NUM
ecletica-1369	159	5	of	of	ADP
ecletica-1369	159	6	all	all	DET
ecletica-1369	159	7	the	the	DET
ecletica-1369	159	8	studied	studied	ADJ
ecletica-1369	159	9	oligomers	oligomer	NOUN
ecletica-1369	159	10	was	be	AUX
ecletica-1369	159	11	lower	low	ADJ
ecletica-1369	159	12	than	than	ADP
ecletica-1369	159	13	their	their	PRON
ecletica-1369	159	14	λ	λ	NOUN
ecletica-1369	159	15	–	–	PUNCT
ecletica-1369	159	16	,	,	PUNCT
ecletica-1369	159	17	except	except	SCONJ
ecletica-1369	159	18	for	for	ADP
ecletica-1369	159	19	the	the	DET
ecletica-1369	159	20	crvbbt	crvbbt	NOUN
ecletica-1369	159	21	oligomer	oligomer	NOUN
ecletica-1369	159	22	,	,	PUNCT
ecletica-1369	159	23	indicating	indicate	VERB
ecletica-1369	159	24	a	a	DET
ecletica-1369	159	25	lower	low	ADJ
ecletica-1369	159	26	hole	hole	NOUN
ecletica-1369	159	27	transfer	transfer	NOUN
ecletica-1369	159	28	cost	cost	NOUN
ecletica-1369	159	29	than	than	ADP
ecletica-1369	159	30	electron	electron	NOUN
ecletica-1369	159	31	transfer	transfer	NOUN
ecletica-1369	159	32	cost	cost	NOUN
ecletica-1369	159	33	with	with	ADP
ecletica-1369	159	34	changes	change	NOUN
ecletica-1369	159	35	in	in	ADP
ecletica-1369	159	36	molecular	molecular	ADJ
ecletica-1369	159	37	geometry	geometry	NOUN
ecletica-1369	159	38	during	during	ADP
ecletica-1369	159	39	this	this	DET
ecletica-1369	159	40	charge	charge	NOUN
ecletica-1369	159	41	transfer	transfer	NOUN
ecletica-1369	159	42	.	.	PUNCT
ecletica-1369	160	1	3.5	3.5	NUM
ecletica-1369	160	2	excitation	excitation	NOUN
ecletica-1369	160	3	state	state	NOUN
ecletica-1369	160	4	calculation	calculation	NOUN
ecletica-1369	160	5	the	the	DET
ecletica-1369	160	6	osc	osc	NOUN
ecletica-1369	160	7	(	(	PUNCT
ecletica-1369	160	8	oligomer	oligomer	ADJ
ecletica-1369	160	9	semi	semi	ADJ
ecletica-1369	160	10	-	-	NOUN
ecletica-1369	160	11	conductor	conductor	ADJ
ecletica-1369	160	12	)	)	PUNCT
ecletica-1369	160	13	coefficient	coefficient	NOUN
ecletica-1369	160	14	of	of	ADP
ecletica-1369	160	15	the	the	DET
ecletica-1369	160	16	studied	study	VERB
ecletica-1369	160	17	molecules	molecule	NOUN
ecletica-1369	160	18	was	be	AUX
ecletica-1369	160	19	obtained	obtain	VERB
ecletica-1369	160	20	by	by	ADP
ecletica-1369	160	21	dft	dft	PROPN
ecletica-1369	160	22	-	-	PUNCT
ecletica-1369	160	23	b3lyp/63	b3lyp/63	PROPN
ecletica-1369	160	24	g	g	PROPN
ecletica-1369	160	25	(	(	PUNCT
ecletica-1369	160	26	d	d	PROPN
ecletica-1369	160	27	,	,	PUNCT
ecletica-1369	160	28	p	p	NOUN
ecletica-1369	160	29	)	)	PUNCT
ecletica-1369	160	30	method	method	NOUN
ecletica-1369	160	31	and	and	CCONJ
ecletica-1369	160	32	the	the	DET
ecletica-1369	160	33	maximum	maximum	ADJ
ecletica-1369	160	34	absorption	absorption	NOUN
ecletica-1369	160	35	wavelength	wavelength	NOUN
ecletica-1369	160	36	(	(	PUNCT
ecletica-1369	160	37	λmax	λmax	NOUN
ecletica-1369	160	38	)	)	PUNCT
ecletica-1369	160	39	,	,	PUNCT
ecletica-1369	160	40	oscillator	oscillator	NOUN
ecletica-1369	160	41	strengths	strength	NOUN
ecletica-1369	160	42	(	(	PUNCT
ecletica-1369	160	43	f	f	X
ecletica-1369	160	44	)	)	PUNCT
ecletica-1369	160	45	and	and	CCONJ
ecletica-1369	160	46	excitation	excitation	NOUN
ecletica-1369	160	47	energy	energy	NOUN
ecletica-1369	160	48	values	value	NOUN
ecletica-1369	160	49	eex	eex	NOUN
ecletica-1369	160	50	(	(	PUNCT
ecletica-1369	160	51	ev	ev	PROPN
ecletica-1369	160	52	)	)	PUNCT
ecletica-1369	160	53	were	be	AUX
ecletica-1369	160	54	obtained	obtain	VERB
ecletica-1369	160	55	.	.	PUNCT
ecletica-1369	161	1	the	the	DET
ecletica-1369	161	2	knowledge	knowledge	NOUN
ecletica-1369	161	3	of	of	ADP
ecletica-1369	161	4	the	the	DET
ecletica-1369	161	5	uv	uv	NOUN
ecletica-1369	161	6	-	-	PUNCT
ecletica-1369	161	7	visible	visible	ADJ
ecletica-1369	161	8	absorptions	absorption	NOUN
ecletica-1369	161	9	of	of	ADP
ecletica-1369	161	10	the	the	DET
ecletica-1369	161	11	studied	study	VERB
ecletica-1369	161	12	oligomers	oligomer	NOUN
ecletica-1369	161	13	contributes	contribute	VERB
ecletica-1369	161	14	to	to	ADP
ecletica-1369	161	15	their	their	PRON
ecletica-1369	161	16	evaluation	evaluation	NOUN
ecletica-1369	161	17	as	as	ADP
ecletica-1369	161	18	potential	potential	ADJ
ecletica-1369	161	19	materials	material	NOUN
ecletica-1369	161	20	in	in	ADP
ecletica-1369	161	21	photovoltaic	photovoltaic	NOUN
ecletica-1369	161	22	applications	application	NOUN
ecletica-1369	161	23	.	.	PUNCT
ecletica-1369	162	1	taking	take	VERB
ecletica-1369	162	2	the	the	DET
ecletica-1369	162	3	optimized	optimize	VERB
ecletica-1369	162	4	structures	structure	NOUN
ecletica-1369	162	5	at	at	ADP
ecletica-1369	162	6	the	the	DET
ecletica-1369	162	7	level	level	NOUN
ecletica-1369	162	8	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	162	9	-	-	PUNCT
ecletica-1369	162	10	31	31	NUM
ecletica-1369	162	11	g	g	NOUN
ecletica-1369	162	12	(	(	PUNCT
ecletica-1369	162	13	d	d	PROPN
ecletica-1369	162	14	,	,	PUNCT
ecletica-1369	162	15	p	p	NOUN
ecletica-1369	162	16	)	)	PUNCT
ecletica-1369	162	17	,	,	PUNCT
ecletica-1369	162	18	we	we	PRON
ecletica-1369	162	19	calculated	calculate	VERB
ecletica-1369	162	20	the	the	DET
ecletica-1369	162	21	uv	uv	NOUN
ecletica-1369	162	22	-	-	PUNCT
ecletica-1369	162	23	visible	visible	ADJ
ecletica-1369	162	24	spectra	spectra	NOUN
ecletica-1369	162	25	of	of	ADP
ecletica-1369	162	26	the	the	DET
ecletica-1369	162	27	oligomers	oligomer	NOUN
ecletica-1369	162	28	at	at	ADP
ecletica-1369	162	29	the	the	DET
ecletica-1369	162	30	level	level	NOUN
ecletica-1369	162	31	td	td	NOUN
ecletica-1369	162	32	-	-	PUNCT
ecletica-1369	162	33	dft	dft	NOUN
ecletica-1369	162	34	-	-	PUNCT
ecletica-1369	162	35	bp86/631g(d	bp86/631g(d	PROPN
ecletica-1369	162	36	,	,	PUNCT
ecletica-1369	162	37	p	p	NOUN
ecletica-1369	162	38	)	)	PUNCT
ecletica-1369	162	39	(	(	PUNCT
ecletica-1369	162	40	burke	burke	PROPN
ecletica-1369	162	41	et	et	PROPN
ecletica-1369	162	42	al	al	PROPN
ecletica-1369	162	43	.	.	PROPN
ecletica-1369	162	44	,	,	PUNCT
ecletica-1369	162	45	1996	1996	NUM
ecletica-1369	162	46	)	)	PUNCT
ecletica-1369	162	47	.	.	PUNCT
ecletica-1369	163	1	3.5.1	3.5.1	NUM
ecletica-1369	163	2	electronic	electronic	ADJ
ecletica-1369	163	3	transition	transition	NOUN
ecletica-1369	163	4	,	,	PUNCT
ecletica-1369	163	5	excitation	excitation	NOUN
ecletica-1369	163	6	energy	energy	NOUN
ecletica-1369	163	7	and	and	CCONJ
ecletica-1369	163	8	oscillation	oscillation	NOUN
ecletica-1369	163	9	strength	strength	NOUN
ecletica-1369	163	10	the	the	DET
ecletica-1369	163	11	calculated	calculated	ADJ
ecletica-1369	163	12	electronic	electronic	ADJ
ecletica-1369	163	13	absorption	absorption	NOUN
ecletica-1369	163	14	spectra	spectra	NOUN
ecletica-1369	163	15	of	of	ADP
ecletica-1369	163	16	the	the	DET
ecletica-1369	163	17	studied	study	VERB
ecletica-1369	163	18	oligomers	oligomer	NOUN
ecletica-1369	163	19	are	be	AUX
ecletica-1369	163	20	shown	show	VERB
ecletica-1369	163	21	in	in	ADP
ecletica-1369	163	22	fig	fig	NOUN
ecletica-1369	163	23	.	.	PUNCT
ecletica-1369	164	1	15	15	NUM
ecletica-1369	164	2	.	.	PUNCT
ecletica-1369	164	3	table	table	NOUN
ecletica-1369	164	4	1	1	NUM
ecletica-1369	164	5	presents	present	VERB
ecletica-1369	164	6	the	the	DET
ecletica-1369	164	7	λmax	λmax	NOUN
ecletica-1369	164	8	,	,	PUNCT
ecletica-1369	164	9	oscillation	oscillation	NOUN
ecletica-1369	164	10	strengths	strength	NOUN
ecletica-1369	164	11	(	(	PUNCT
ecletica-1369	164	12	f	f	NOUN
ecletica-1369	164	13	)	)	PUNCT
ecletica-1369	164	14	,	,	PUNCT
ecletica-1369	164	15	and	and	CCONJ
ecletica-1369	164	16	excitation	excitation	NOUN
ecletica-1369	164	17	energy	energy	NOUN
ecletica-1369	164	18	values	value	NOUN
ecletica-1369	164	19	eex	eex	NOUN
ecletica-1369	164	20	(	(	PUNCT
ecletica-1369	164	21	ev	ev	PROPN
ecletica-1369	164	22	)	)	PUNCT
ecletica-1369	164	23	.	.	PUNCT
ecletica-1369	165	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	165	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	PROPN
ecletica-1369	165	3	original	original	ADJ
ecletica-1369	165	4	article	article	NOUN
ecletica-1369	165	5	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1369	165	6	65	65	NUM
ecletica-1369	165	7	eclética	eclética	PROPN
ecletica-1369	165	8	química	química	PROPN
ecletica-1369	165	9	journal	journal	PROPN
ecletica-1369	165	10	,	,	PUNCT
ecletica-1369	165	11	vol	vol	NOUN
ecletica-1369	165	12	.	.	PROPN
ecletica-1369	165	13	47	47	NUM
ecletica-1369	165	14	,	,	PUNCT
ecletica-1369	165	15	n.	n.	NOUN
ecletica-1369	165	16	4	4	NUM
ecletica-1369	165	17	,	,	PUNCT
ecletica-1369	165	18	2022	2022	NUM
ecletica-1369	165	19	,	,	PUNCT
ecletica-1369	165	20	55	55	NUM
ecletica-1369	165	21	-	-	SYM
ecletica-1369	165	22	68	68	NUM
ecletica-1369	165	23	issn	issn	NOUN
ecletica-1369	165	24	:	:	PUNCT
ecletica-1369	165	25	1678	1678	NUM
ecletica-1369	165	26	-	-	SYM
ecletica-1369	165	27	4618	4618	NUM
ecletica-1369	165	28	doi	doi	NOUN
ecletica-1369	165	29	:	:	PUNCT
ecletica-1369	165	30	10.26850/1678	10.26850/1678	NUM
ecletica-1369	165	31	-	-	SYM
ecletica-1369	165	32	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	165	33	-	-	PUNCT
ecletica-1369	165	34	68	68	NUM
ecletica-1369	165	35	figure	figure	NOUN
ecletica-1369	165	36	15	15	NUM
ecletica-1369	165	37	.	.	PUNCT
ecletica-1369	166	1	percent	percent	NOUN
ecletica-1369	166	2	of	of	ADP
ecletica-1369	166	3	osc	osc	NOUN
ecletica-1369	166	4	of	of	ADP
ecletica-1369	166	5	the	the	DET
ecletica-1369	166	6	molecules	molecule	NOUN
ecletica-1369	166	7	studied	study	VERB
ecletica-1369	166	8	by	by	ADP
ecletica-1369	166	9	the	the	DET
ecletica-1369	166	10	dft	dft	PROPN
ecletica-1369	166	11	-	-	PUNCT
ecletica-1369	166	12	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	166	13	-	-	PUNCT
ecletica-1369	166	14	3	3	NUM
ecletica-1369	166	15	g	g	NOUN
ecletica-1369	166	16	method	method	NOUN
ecletica-1369	166	17	(	(	PUNCT
ecletica-1369	166	18	d	d	NOUN
ecletica-1369	166	19	,	,	PUNCT
ecletica-1369	166	20	p	p	NOUN
ecletica-1369	166	21	)	)	PUNCT
ecletica-1369	166	22	.	.	PUNCT
ecletica-1369	167	1	table	table	NOUN
ecletica-1369	168	1	1	1	NUM
ecletica-1369	168	2	.	.	PUNCT
ecletica-1369	168	3	electronic	electronic	ADJ
ecletica-1369	168	4	transition	transition	NOUN
ecletica-1369	168	5	data	datum	NOUN
ecletica-1369	168	6	obtained	obtain	VERB
ecletica-1369	168	7	by	by	ADP
ecletica-1369	168	8	td	td	NOUN
ecletica-1369	168	9	-	-	PUNCT
ecletica-1369	168	10	dftbp86/6	dftbp86/6	NOUN
ecletica-1369	168	11	-	-	PUNCT
ecletica-1369	168	12	31	31	NUM
ecletica-1369	168	13	g	g	NOUN
ecletica-1369	168	14	(	(	PUNCT
ecletica-1369	168	15	d	d	PROPN
ecletica-1369	168	16	,	,	PUNCT
ecletica-1369	168	17	p	p	NOUN
ecletica-1369	168	18	)	)	PUNCT
ecletica-1369	168	19	calculation	calculation	NOUN
ecletica-1369	168	20	for	for	ADP
ecletica-1369	168	21	all	all	DET
ecletica-1369	168	22	oligomers	oligomer	NOUN
ecletica-1369	168	23	models	model	NOUN
ecletica-1369	168	24	.	.	PUNCT
ecletica-1369	169	1	compound	compound	NOUN
ecletica-1369	169	2	dft	dft	PROPN
ecletica-1369	169	3	-	-	PUNCT
ecletica-1369	169	4	bp86/6	bp86/6	PROPN
ecletica-1369	169	5	-	-	PUNCT
ecletica-1369	169	6	31	31	NUM
ecletica-1369	169	7	g	g	NOUN
ecletica-1369	169	8	(	(	PUNCT
ecletica-1369	169	9	d.p	d.p	PROPN
ecletica-1369	169	10	)	)	PUNCT
ecletica-1369	169	11	λmax	λmax	NOUN
ecletica-1369	169	12	‘	'	PUNCT
ecletica-1369	169	13	exp	exp	NOUN
ecletica-1369	169	14	’	'	PUNCT
ecletica-1369	169	15	(	(	PUNCT
ecletica-1369	169	16	nm	nm	NOUN
ecletica-1369	169	17	)	)	PUNCT
ecletica-1369	169	18	*	*	PUNCT
ecletica-1369	169	19	eex	eex	PROPN
ecletica-1369	169	20	(	(	PUNCT
ecletica-1369	169	21	ev	ev	PROPN
ecletica-1369	169	22	)	)	PUNCT
ecletica-1369	169	23	f	f	PROPN
ecletica-1369	169	24	λmax	λmax	NOUN
ecletica-1369	169	25	(	(	PUNCT
ecletica-1369	169	26	nm	nm	NOUN
ecletica-1369	169	27	)	)	PUNCT
ecletica-1369	169	28	crv	crv	PROPN
ecletica-1369	169	29	-	-	PUNCT
ecletica-1369	169	30	h	h	PROPN
ecletica-1369	169	31	3.1182	3.1182	NUM
ecletica-1369	169	32	0.0354	0.0354	NUM
ecletica-1369	169	33	397.62	397.62	NUM
ecletica-1369	169	34	436	436	NUM
ecletica-1369	169	35	3.5174	3.5174	NUM
ecletica-1369	169	36	0.0051	0.0051	NUM
ecletica-1369	169	37	352.49	352.49	NUM
ecletica-1369	169	38	3.6101	3.6101	NUM
ecletica-1369	169	39	0.0006	0.0006	NUM
ecletica-1369	169	40	343.44	343.44	NUM
ecletica-1369	169	41	crv	crv	PROPN
ecletica-1369	169	42	-	-	PUNCT
ecletica-1369	169	43	t	t	PROPN
ecletica-1369	169	44	2.6142	2.6142	NUM
ecletica-1369	169	45	0.0222	0.0222	NUM
ecletica-1369	169	46	474.28	474.28	NUM
ecletica-1369	169	47	466	466	NUM
ecletica-1369	169	48	2.8195	2.8195	NUM
ecletica-1369	169	49	1.2246	1.2246	NUM
ecletica-1369	169	50	439.74	439.74	NUM
ecletica-1369	169	51	3.0152	3.0152	NUM
ecletica-1369	169	52	0.0061	0.0061	NUM
ecletica-1369	169	53	411.20	411.20	NUM
ecletica-1369	169	54	cv	cv	PROPN
ecletica-1369	169	55	-	-	PUNCT
ecletica-1369	169	56	bbt	bbt	PROPN
ecletica-1369	169	57	1.1671	1.1671	NUM
ecletica-1369	169	58	0.0027	0.0027	NUM
ecletica-1369	169	59	1062.34	1062.34	NUM
ecletica-1369	169	60	1.3509	1.3509	NUM
ecletica-1369	169	61	0.3658	0.3658	NUM
ecletica-1369	169	62	917.77	917.77	NUM
ecletica-1369	169	63	1.8504	1.8504	NUM
ecletica-1369	169	64	0.0098	0.0098	NUM
ecletica-1369	169	65	670.04	670.04	NUM
ecletica-1369	169	66	crv	crv	PROPN
ecletica-1369	169	67	-	-	PUNCT
ecletica-1369	169	68	ttn	ttn	PROPN
ecletica-1369	169	69	1.2660	1.2660	NUM
ecletica-1369	169	70	0.0028	0.0028	NUM
ecletica-1369	169	71	979.37	979.37	NUM
ecletica-1369	169	72	1.4403	1.4403	NUM
ecletica-1369	169	73	0.3549	0.3549	NUM
ecletica-1369	169	74	860.84	860.84	NUM
ecletica-1369	169	75	2.0194	2.0194	NUM
ecletica-1369	169	76	0.0317	0.0317	NUM
ecletica-1369	169	77	613.96	613.96	NUM
ecletica-1369	169	78	crv	crv	NOUN
ecletica-1369	169	79	-	-	PUNCT
ecletica-1369	169	80	pp	pp	PROPN
ecletica-1369	169	81	1.7405	1.7405	NUM
ecletica-1369	169	82	0.0036	0.0036	NUM
ecletica-1369	169	83	712.35	712.35	NUM
ecletica-1369	169	84	1.8352	1.8352	NUM
ecletica-1369	169	85	0.2258	0.2258	NUM
ecletica-1369	169	86	675.59	675.59	NUM
ecletica-1369	169	87	2.5562	2.5562	NUM
ecletica-1369	169	88	0.0051	0.0051	NUM
ecletica-1369	169	89	485.02	485.02	NUM
ecletica-1369	169	90	crv	crv	PROPN
ecletica-1369	169	91	-	-	PUNCT
ecletica-1369	169	92	pt	pt	PROPN
ecletica-1369	169	93	2.2100	2.2100	NUM
ecletica-1369	169	94	1.9128	1.9128	NUM
ecletica-1369	169	95	561.02	561.02	NUM
ecletica-1369	169	96	2.3550	2.3550	NUM
ecletica-1369	169	97	0.0102	0.0102	NUM
ecletica-1369	169	98	526.47	526.47	NUM
ecletica-1369	169	99	2.4545	2.4545	NUM
ecletica-1369	169	100	0.0408	0.0408	NUM
ecletica-1369	169	101	505.13	505.13	NUM
ecletica-1369	169	102	*	*	PUNCT
ecletica-1369	169	103	leclerc	leclerc	PROPN
ecletica-1369	169	104	et	et	PROPN
ecletica-1369	169	105	al	al	PROPN
ecletica-1369	169	106	.	.	PROPN
ecletica-1369	170	1	(	(	PUNCT
ecletica-1369	170	2	2006	2006	NUM
ecletica-1369	170	3	)	)	PUNCT
ecletica-1369	170	4	as	as	SCONJ
ecletica-1369	170	5	presented	present	VERB
ecletica-1369	170	6	in	in	ADP
ecletica-1369	170	7	tab	tab	NOUN
ecletica-1369	170	8	.	.	PUNCT
ecletica-1369	171	1	1	1	NUM
ecletica-1369	171	2	,	,	PUNCT
ecletica-1369	171	3	the	the	DET
ecletica-1369	171	4	maximum	maximum	ADJ
ecletica-1369	171	5	absorption	absorption	NOUN
ecletica-1369	171	6	wavelength	wavelength	NOUN
ecletica-1369	171	7	λmax	λmax	NOUN
ecletica-1369	171	8	of	of	ADP
ecletica-1369	171	9	the	the	DET
ecletica-1369	171	10	reference	reference	NOUN
ecletica-1369	171	11	oligomers	oligomer	NOUN
ecletica-1369	171	12	(	(	PUNCT
ecletica-1369	171	13	crv	crv	PROPN
ecletica-1369	171	14	-	-	PUNCT
ecletica-1369	171	15	h	h	PROPN
ecletica-1369	171	16	,	,	PUNCT
ecletica-1369	171	17	crv	crv	PROPN
ecletica-1369	171	18	-	-	PUNCT
ecletica-1369	171	19	t	t	PROPN
ecletica-1369	171	20	)	)	PUNCT
ecletica-1369	171	21	(	(	PUNCT
ecletica-1369	171	22	397.62	397.62	NUM
ecletica-1369	171	23	and	and	CCONJ
ecletica-1369	171	24	474.28	474.28	NUM
ecletica-1369	171	25	nm	nm	NOUN
ecletica-1369	171	26	)	)	PUNCT
ecletica-1369	171	27	correlates	correlate	VERB
ecletica-1369	171	28	perfectly	perfectly	ADV
ecletica-1369	171	29	with	with	ADP
ecletica-1369	171	30	the	the	DET
ecletica-1369	171	31	available	available	ADJ
ecletica-1369	171	32	experimental	experimental	ADJ
ecletica-1369	171	33	values	value	NOUN
ecletica-1369	171	34	(	(	PUNCT
ecletica-1369	171	35	of	of	ADP
ecletica-1369	171	36	436	436	NUM
ecletica-1369	171	37	and	and	CCONJ
ecletica-1369	171	38	466	466	NUM
ecletica-1369	171	39	nm	nm	NOUN
ecletica-1369	171	40	,	,	PUNCT
ecletica-1369	171	41	respectively	respectively	ADV
ecletica-1369	171	42	)	)	PUNCT
ecletica-1369	171	43	(	(	PUNCT
ecletica-1369	171	44	leclerc	leclerc	PROPN
ecletica-1369	171	45	et	et	PROPN
ecletica-1369	171	46	al	al	PROPN
ecletica-1369	171	47	.	.	PROPN
ecletica-1369	171	48	,	,	PUNCT
ecletica-1369	171	49	2006	2006	NUM
ecletica-1369	171	50	)	)	PUNCT
ecletica-1369	171	51	,	,	PUNCT
ecletica-1369	171	52	suggesting	suggest	VERB
ecletica-1369	171	53	that	that	SCONJ
ecletica-1369	171	54	tdbp86/6	tdbp86/6	NOUN
ecletica-1369	171	55	-	-	SYM
ecletica-1369	171	56	31	31	NUM
ecletica-1369	171	57	g	g	NOUN
ecletica-1369	171	58	(	(	PUNCT
ecletica-1369	171	59	d	d	PROPN
ecletica-1369	171	60	,	,	PUNCT
ecletica-1369	171	61	p	p	NOUN
ecletica-1369	171	62	)	)	PUNCT
ecletica-1369	171	63	was	be	AUX
ecletica-1369	171	64	a	a	DET
ecletica-1369	171	65	suitable	suitable	ADJ
ecletica-1369	171	66	level	level	NOUN
ecletica-1369	171	67	to	to	PART
ecletica-1369	171	68	predict	predict	VERB
ecletica-1369	171	69	the	the	DET
ecletica-1369	171	70	evolution	evolution	NOUN
ecletica-1369	171	71	of	of	ADP
ecletica-1369	171	72	the	the	DET
ecletica-1369	171	73	optoelectronic	optoelectronic	ADJ
ecletica-1369	171	74	properties	property	NOUN
ecletica-1369	171	75	of	of	ADP
ecletica-1369	171	76	the	the	DET
ecletica-1369	171	77	oligomers	oligomer	NOUN
ecletica-1369	171	78	.	.	PUNCT
ecletica-1369	172	1	molecules	molecule	NOUN
ecletica-1369	172	2	with	with	ADP
ecletica-1369	172	3	gap	gap	NOUN
ecletica-1369	172	4	energies	energy	NOUN
ecletica-1369	172	5	below	below	ADP
ecletica-1369	172	6	2.87	2.87	NUM
ecletica-1369	172	7	ev	ev	NOUN
ecletica-1369	172	8	absorb	absorb	VERB
ecletica-1369	172	9	light	light	NOUN
ecletica-1369	172	10	in	in	ADP
ecletica-1369	172	11	the	the	DET
ecletica-1369	172	12	visible	visible	ADJ
ecletica-1369	172	13	range	range	NOUN
ecletica-1369	172	14	and	and	CCONJ
ecletica-1369	172	15	crv	crv	PROPN
ecletica-1369	172	16	-	-	PUNCT
ecletica-1369	172	17	ttn	ttn	PROPN
ecletica-1369	172	18	and	and	CCONJ
ecletica-1369	172	19	crv	crv	PROPN
ecletica-1369	172	20	-	-	PUNCT
ecletica-1369	172	21	bbt	bbt	PROPN
ecletica-1369	172	22	oligomers	oligomer	NOUN
ecletica-1369	172	23	absorb	absorb	VERB
ecletica-1369	172	24	in	in	ADP
ecletica-1369	172	25	the	the	DET
ecletica-1369	172	26	infrared	infrared	NOUN
ecletica-1369	172	27	,	,	PUNCT
ecletica-1369	172	28	so	so	ADV
ecletica-1369	172	29	with	with	ADP
ecletica-1369	172	30	low	low	ADJ
ecletica-1369	172	31	excitation	excitation	NOUN
ecletica-1369	172	32	energy	energy	NOUN
ecletica-1369	172	33	(	(	PUNCT
ecletica-1369	172	34	1.16–1.26	1.16–1.26	NUM
ecletica-1369	172	35	ev	ev	NOUN
ecletica-1369	172	36	)	)	PUNCT
ecletica-1369	172	37	one	one	NOUN
ecletica-1369	172	38	can	can	AUX
ecletica-1369	172	39	excite	excite	VERB
ecletica-1369	172	40	electrons	electron	NOUN
ecletica-1369	172	41	from	from	ADP
ecletica-1369	172	42	homo	homo	NOUN
ecletica-1369	172	43	to	to	ADP
ecletica-1369	172	44	lumo	lumo	NOUN
ecletica-1369	172	45	.	.	PUNCT
ecletica-1369	173	1	figure	figure	NOUN
ecletica-1369	173	2	15	15	NUM
ecletica-1369	173	3	shows	show	VERB
ecletica-1369	173	4	that	that	SCONJ
ecletica-1369	173	5	all	all	DET
ecletica-1369	173	6	the	the	DET
ecletica-1369	173	7	substituted	substitute	VERB
ecletica-1369	173	8	molecules	molecule	NOUN
ecletica-1369	173	9	have	have	VERB
ecletica-1369	173	10	an	an	DET
ecletica-1369	173	11	important	important	ADJ
ecletica-1369	173	12	proportion	proportion	NOUN
ecletica-1369	173	13	of	of	ADP
ecletica-1369	173	14	osc	osc	NOUN
ecletica-1369	173	15	,	,	PUNCT
ecletica-1369	173	16	compared	compare	VERB
ecletica-1369	173	17	to	to	ADP
ecletica-1369	173	18	that	that	PRON
ecletica-1369	173	19	of	of	ADP
ecletica-1369	173	20	the	the	DET
ecletica-1369	173	21	basic	basic	ADJ
ecletica-1369	173	22	oligomer	oligomer	NOUN
ecletica-1369	173	23	(	(	PUNCT
ecletica-1369	173	24	crv	crv	NOUN
ecletica-1369	173	25	-	-	PUNCT
ecletica-1369	173	26	h	h	NOUN
ecletica-1369	173	27	)	)	PUNCT
ecletica-1369	173	28	,	,	PUNCT
ecletica-1369	173	29	which	which	PRON
ecletica-1369	173	30	implies	imply	VERB
ecletica-1369	173	31	an	an	DET
ecletica-1369	173	32	increase	increase	NOUN
ecletica-1369	173	33	of	of	ADP
ecletica-1369	173	34	the	the	DET
ecletica-1369	173	35	rate	rate	NOUN
ecletica-1369	173	36	of	of	ADP
ecletica-1369	173	37	excitation	excitation	NOUN
ecletica-1369	173	38	in	in	ADP
ecletica-1369	173	39	these	these	DET
ecletica-1369	173	40	molecules	molecule	NOUN
ecletica-1369	173	41	,	,	PUNCT
ecletica-1369	173	42	as	as	ADV
ecletica-1369	173	43	well	well	ADV
ecletica-1369	173	44	as	as	ADP
ecletica-1369	173	45	the	the	DET
ecletica-1369	173	46	transfer	transfer	NOUN
ecletica-1369	173	47	of	of	ADP
ecletica-1369	173	48	charge	charge	NOUN
ecletica-1369	173	49	from	from	ADP
ecletica-1369	173	50	the	the	DET
ecletica-1369	173	51	homo	homo	NOUN
ecletica-1369	173	52	level	level	NOUN
ecletica-1369	173	53	to	to	ADP
ecletica-1369	173	54	lumo	lumo	NOUN
ecletica-1369	173	55	will	will	AUX
ecletica-1369	173	56	be	be	AUX
ecletica-1369	173	57	easier	easy	ADJ
ecletica-1369	173	58	,	,	PUNCT
ecletica-1369	173	59	with	with	ADP
ecletica-1369	173	60	a	a	DET
ecletica-1369	173	61	low	low	ADJ
ecletica-1369	173	62	energy	energy	NOUN
ecletica-1369	173	63	of	of	ADP
ecletica-1369	173	64	excitation	excitation	NOUN
ecletica-1369	173	65	.	.	PUNCT
ecletica-1369	174	1	3.5.2	3.5.2	NUM
ecletica-1369	174	2	absorption	absorption	NOUN
ecletica-1369	174	3	spectrum	spectrum	NOUN
ecletica-1369	174	4	figure	figure	NOUN
ecletica-1369	174	5	16	16	NUM
ecletica-1369	174	6	shows	show	VERB
ecletica-1369	174	7	uv	uv	NOUN
ecletica-1369	174	8	-	-	PUNCT
ecletica-1369	174	9	vis	vis	X
ecletica-1369	174	10	spectra	spectra	NOUN
ecletica-1369	174	11	of	of	ADP
ecletica-1369	174	12	all	all	DET
ecletica-1369	174	13	oligomers	oligomer	NOUN
ecletica-1369	174	14	calculated	calculate	VERB
ecletica-1369	174	15	at	at	ADP
ecletica-1369	174	16	dft	dft	PROPN
ecletica-1369	174	17	-	-	PUNCT
ecletica-1369	174	18	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	174	19	-	-	NOUN
ecletica-1369	174	20	31g(d	31g(d	PROPN
ecletica-1369	174	21	,	,	PUNCT
ecletica-1369	174	22	p	p	NOUN
ecletica-1369	174	23	)	)	PUNCT
ecletica-1369	174	24	level	level	NOUN
ecletica-1369	174	25	.	.	PUNCT
ecletica-1369	175	1	figure	figure	NOUN
ecletica-1369	175	2	16	16	NUM
ecletica-1369	175	3	.	.	PUNCT
ecletica-1369	176	1	data	datum	NOUN
ecletica-1369	176	2	of	of	ADP
ecletica-1369	176	3	uv	uv	NOUN
ecletica-1369	176	4	-	-	PUNCT
ecletica-1369	176	5	vis	vis	X
ecletica-1369	176	6	spectra	spectra	NOUN
ecletica-1369	176	7	of	of	ADP
ecletica-1369	176	8	all	all	DET
ecletica-1369	176	9	oligomers	oligomer	NOUN
ecletica-1369	176	10	calculated	calculate	VERB
ecletica-1369	176	11	at	at	ADP
ecletica-1369	176	12	dft	dft	PROPN
ecletica-1369	176	13	-	-	PUNCT
ecletica-1369	176	14	b3lyp/6	b3lyp/6	NOUN
ecletica-1369	176	15	-	-	NOUN
ecletica-1369	176	16	31g(d	31g(d	PROPN
ecletica-1369	176	17	,	,	PUNCT
ecletica-1369	176	18	p	p	NOUN
ecletica-1369	176	19	)	)	PUNCT
ecletica-1369	176	20	level	level	NOUN
ecletica-1369	176	21	.	.	PUNCT
ecletica-1369	177	1	source	source	NOUN
ecletica-1369	177	2	:	:	PUNCT
ecletica-1369	177	3	adapted	adapt	VERB
ecletica-1369	177	4	from	from	ADP
ecletica-1369	177	5	jabha	jabha	PROPN
ecletica-1369	177	6	et	et	PROPN
ecletica-1369	177	7	al	al	PROPN
ecletica-1369	177	8	.	.	PROPN
ecletica-1369	177	9	(	(	PUNCT
ecletica-1369	177	10	2022	2022	NUM
ecletica-1369	177	11	)	)	PUNCT
ecletica-1369	177	12	.	.	PUNCT
ecletica-1369	178	1	all	all	DET
ecletica-1369	178	2	the	the	DET
ecletica-1369	178	3	studied	study	VERB
ecletica-1369	178	4	oligomers	oligomer	NOUN
ecletica-1369	178	5	have	have	VERB
ecletica-1369	178	6	absorption	absorption	NOUN
ecletica-1369	178	7	spectral	spectral	ADJ
ecletica-1369	178	8	bands	band	NOUN
ecletica-1369	178	9	obtained	obtain	VERB
ecletica-1369	178	10	by	by	ADP
ecletica-1369	178	11	dft	dft	PROPN
ecletica-1369	178	12	method	method	NOUN
ecletica-1369	178	13	that	that	PRON
ecletica-1369	178	14	can	can	AUX
ecletica-1369	178	15	be	be	AUX
ecletica-1369	178	16	attributed	attribute	VERB
ecletica-1369	178	17	to	to	ADP
ecletica-1369	178	18	the	the	DET
ecletica-1369	178	19	intermolecular	intermolecular	ADJ
ecletica-1369	178	20	transfer	transfer	NOUN
ecletica-1369	178	21	charge	charge	NOUN
ecletica-1369	178	22	in	in	ADP
ecletica-1369	178	23	the	the	DET
ecletica-1369	178	24	structures	structure	NOUN
ecletica-1369	178	25	of	of	ADP
ecletica-1369	178	26	these	these	DET
ecletica-1369	178	27	molecules	molecule	NOUN
ecletica-1369	178	28	.	.	PUNCT
ecletica-1369	179	1	this	this	PRON
ecletica-1369	179	2	indicates	indicate	VERB
ecletica-1369	179	3	that	that	SCONJ
ecletica-1369	179	4	these	these	DET
ecletica-1369	179	5	organic	organic	ADJ
ecletica-1369	179	6	materials	material	NOUN
ecletica-1369	179	7	could	could	AUX
ecletica-1369	179	8	absorb	absorb	VERB
ecletica-1369	179	9	the	the	DET
ecletica-1369	179	10	maximum	maximum	ADJ
ecletica-1369	179	11	incident	incident	NOUN
ecletica-1369	179	12	light	light	ADJ
ecletica-1369	179	13	radiation	radiation	NOUN
ecletica-1369	179	14	.	.	PUNCT
ecletica-1369	180	1	the	the	DET
ecletica-1369	180	2	energy	energy	NOUN
ecletica-1369	180	3	range	range	NOUN
ecletica-1369	180	4	for	for	ADP
ecletica-1369	180	5	all	all	DET
ecletica-1369	180	6	the	the	DET
ecletica-1369	180	7	structures	structure	NOUN
ecletica-1369	180	8	studied	study	VERB
ecletica-1369	180	9	is	be	AUX
ecletica-1369	180	10	generally	generally	ADV
ecletica-1369	180	11	in	in	ADP
ecletica-1369	180	12	the	the	DET
ecletica-1369	180	13	visible	visible	ADJ
ecletica-1369	180	14	and	and	CCONJ
ecletica-1369	180	15	near	near	ADP
ecletica-1369	180	16	infrared	infrared	PROPN
ecletica-1369	180	17	,	,	PUNCT
ecletica-1369	180	18	however	however	ADV
ecletica-1369	180	19	the	the	DET
ecletica-1369	180	20	crv	crv	PROPN
ecletica-1369	180	21	-	-	PUNCT
ecletica-1369	180	22	bbt	bbt	PROPN
ecletica-1369	180	23	oligomer	oligomer	PROPN
ecletica-1369	180	24	has	have	VERB
ecletica-1369	180	25	a	a	DET
ecletica-1369	180	26	dual	dual	ADJ
ecletica-1369	180	27	excitation	excitation	NOUN
ecletica-1369	180	28	band	band	NOUN
ecletica-1369	180	29	,	,	PUNCT
ecletica-1369	180	30	one	one	NUM
ecletica-1369	180	31	of	of	ADP
ecletica-1369	180	32	which	which	PRON
ecletica-1369	180	33	is	be	AUX
ecletica-1369	180	34	broad	broad	ADJ
ecletica-1369	180	35	like	like	ADP
ecletica-1369	180	36	that	that	PRON
ecletica-1369	180	37	of	of	ADP
ecletica-1369	180	38	the	the	DET
ecletica-1369	180	39	reference	reference	NOUN
ecletica-1369	180	40	oligomer	oligomer	NOUN
ecletica-1369	180	41	(	(	PUNCT
ecletica-1369	180	42	crvh	crvh	NOUN
ecletica-1369	180	43	)	)	PUNCT
ecletica-1369	180	44	.	.	PUNCT
ecletica-1369	181	1	3.5.3	3.5.3	NUM
ecletica-1369	181	2	photovoltaic	photovoltaic	NOUN
ecletica-1369	181	3	properties	property	NOUN
ecletica-1369	181	4	theoretically	theoretically	ADV
ecletica-1369	181	5	the	the	DET
ecletica-1369	181	6	open	open	ADJ
ecletica-1369	181	7	circuit	circuit	NOUN
ecletica-1369	181	8	voltage	voltage	NOUN
ecletica-1369	181	9	(	(	PUNCT
ecletica-1369	181	10	voc	voc	NOUN
ecletica-1369	181	11	)	)	PUNCT
ecletica-1369	181	12	and	and	CCONJ
ecletica-1369	181	13	α	α	PROPN
ecletica-1369	181	14	were	be	AUX
ecletica-1369	181	15	calculated	calculate	VERB
ecletica-1369	181	16	from	from	ADP
ecletica-1369	181	17	eqs	eqs	PROPN
ecletica-1369	181	18	.	.	PROPN
ecletica-1369	181	19	9	9	NUM
ecletica-1369	181	20	and	and	CCONJ
ecletica-1369	181	21	10	10	NUM
ecletica-1369	181	22	(	(	PUNCT
ecletica-1369	181	23	jabha	jabha	PROPN
ecletica-1369	181	24	et	et	PROPN
ecletica-1369	181	25	al	al	PROPN
ecletica-1369	181	26	.	.	PROPN
ecletica-1369	181	27	,	,	PUNCT
ecletica-1369	181	28	2018	2018	NUM
ecletica-1369	181	29	):	):	PUNCT
ecletica-1369	181	30	voc	voc	NOUN
ecletica-1369	181	31	=	=	NOUN
ecletica-1369	181	32	│	│	X
ecletica-1369	181	33	e	e	NOUN
ecletica-1369	181	34	homo(donor	homo(donor	PROPN
ecletica-1369	181	35	)	)	PUNCT
ecletica-1369	181	36	│	│	NUM
ecletica-1369	181	37	–	–	PUNCT
ecletica-1369	181	38	│	│	VERB
ecletica-1369	181	39	elumo	elumo	ADJ
ecletica-1369	181	40	(	(	PUNCT
ecletica-1369	181	41	acceptor	acceptor	NOUN
ecletica-1369	181	42	)	)	PUNCT
ecletica-1369	181	43	│	│	NUM
ecletica-1369	181	44	–	–	PUNCT
ecletica-1369	181	45	0.3	0.3	NUM
ecletica-1369	181	46	(	(	PUNCT
ecletica-1369	181	47	9	9	NUM
ecletica-1369	181	48	)	)	PUNCT
ecletica-1369	181	49	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	NOUN
ecletica-1369	181	50	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	NOUN
ecletica-1369	181	51	original	original	ADJ
ecletica-1369	181	52	article	article	NOUN
ecletica-1369	181	53	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1369	181	54	66	66	NUM
ecletica-1369	181	55	eclética	eclética	PROPN
ecletica-1369	181	56	química	química	PROPN
ecletica-1369	181	57	journal	journal	PROPN
ecletica-1369	181	58	,	,	PUNCT
ecletica-1369	181	59	vol	vol	NOUN
ecletica-1369	181	60	.	.	PROPN
ecletica-1369	181	61	47	47	NUM
ecletica-1369	181	62	,	,	PUNCT
ecletica-1369	181	63	n.	n.	NOUN
ecletica-1369	181	64	4	4	NUM
ecletica-1369	181	65	,	,	PUNCT
ecletica-1369	181	66	2022	2022	NUM
ecletica-1369	181	67	,	,	PUNCT
ecletica-1369	181	68	55	55	NUM
ecletica-1369	181	69	-	-	SYM
ecletica-1369	181	70	68	68	NUM
ecletica-1369	181	71	issn	issn	NOUN
ecletica-1369	181	72	:	:	PUNCT
ecletica-1369	181	73	1678	1678	NUM
ecletica-1369	181	74	-	-	SYM
ecletica-1369	181	75	4618	4618	NUM
ecletica-1369	181	76	doi	doi	NOUN
ecletica-1369	181	77	:	:	PUNCT
ecletica-1369	181	78	10.26850/1678	10.26850/1678	NUM
ecletica-1369	181	79	-	-	SYM
ecletica-1369	181	80	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	181	81	-	-	PUNCT
ecletica-1369	181	82	68	68	NUM
ecletica-1369	181	83	α	α	NOUN
ecletica-1369	181	84	=	=	SYM
ecletica-1369	181	85	│	│	NOUN
ecletica-1369	181	86	e	e	NOUN
ecletica-1369	181	87	lumo	lumo	NOUN
ecletica-1369	181	88	(	(	PUNCT
ecletica-1369	181	89	acceptor	acceptor	NOUN
ecletica-1369	181	90	)	)	PUNCT
ecletica-1369	181	91	│	│	NUM
ecletica-1369	181	92	–	–	PUNCT
ecletica-1369	181	93	│	│	VERB
ecletica-1369	181	94	elumo	elumo	ADJ
ecletica-1369	181	95	(	(	PUNCT
ecletica-1369	181	96	donor	donor	NOUN
ecletica-1369	181	97	)	)	PUNCT
ecletica-1369	181	98	│	│	X
ecletica-1369	181	99	(	(	PUNCT
ecletica-1369	181	100	10	10	NUM
ecletica-1369	181	101	)	)	PUNCT
ecletica-1369	181	102	the	the	DET
ecletica-1369	181	103	voc	voc	NOUN
ecletica-1369	181	104	is	be	AUX
ecletica-1369	181	105	obtained	obtain	VERB
ecletica-1369	181	106	when	when	SCONJ
ecletica-1369	181	107	the	the	DET
ecletica-1369	181	108	current	current	NOUN
ecletica-1369	181	109	through	through	ADP
ecletica-1369	181	110	the	the	DET
ecletica-1369	181	111	cell	cell	NOUN
ecletica-1369	181	112	is	be	AUX
ecletica-1369	181	113	zero	zero	NUM
ecletica-1369	181	114	.	.	PUNCT
ecletica-1369	182	1	in	in	ADP
ecletica-1369	182	2	the	the	DET
ecletica-1369	182	3	case	case	NOUN
ecletica-1369	182	4	of	of	ADP
ecletica-1369	182	5	organic	organic	ADJ
ecletica-1369	182	6	solar	solar	ADJ
ecletica-1369	182	7	cells	cell	NOUN
ecletica-1369	182	8	,	,	PUNCT
ecletica-1369	182	9	the	the	DET
ecletica-1369	182	10	voc	voc	NOUN
ecletica-1369	182	11	is	be	AUX
ecletica-1369	182	12	linearly	linearly	ADV
ecletica-1369	182	13	dependent	dependent	ADJ
ecletica-1369	182	14	on	on	ADP
ecletica-1369	182	15	the	the	DET
ecletica-1369	182	16	homo	homo	NOUN
ecletica-1369	182	17	level	level	NOUN
ecletica-1369	182	18	of	of	ADP
ecletica-1369	182	19	the	the	DET
ecletica-1369	182	20	donor	donor	NOUN
ecletica-1369	182	21	material	material	NOUN
ecletica-1369	182	22	and	and	CCONJ
ecletica-1369	182	23	the	the	DET
ecletica-1369	182	24	lumo	lumo	ADJ
ecletica-1369	182	25	level	level	NOUN
ecletica-1369	182	26	of	of	ADP
ecletica-1369	182	27	the	the	DET
ecletica-1369	182	28	acceptor	acceptor	NOUN
ecletica-1369	182	29	material	material	NOUN
ecletica-1369	182	30	(	(	PUNCT
ecletica-1369	182	31	brabec	brabec	NOUN
ecletica-1369	182	32	et	et	PROPN
ecletica-1369	182	33	al	al	PROPN
ecletica-1369	182	34	.	.	PROPN
ecletica-1369	182	35	,	,	PUNCT
ecletica-1369	182	36	2001	2001	NUM
ecletica-1369	182	37	)	)	PUNCT
ecletica-1369	182	38	.	.	PUNCT
ecletica-1369	183	1	in	in	ADP
ecletica-1369	183	2	addition	addition	NOUN
ecletica-1369	183	3	,	,	PUNCT
ecletica-1369	183	4	charge	charge	NOUN
ecletica-1369	183	5	losses	loss	NOUN
ecletica-1369	183	6	at	at	ADP
ecletica-1369	183	7	the	the	DET
ecletica-1369	183	8	material	material	NOUN
ecletica-1369	183	9	-	-	PUNCT
ecletica-1369	183	10	electrode	electrode	NOUN
ecletica-1369	183	11	interfaces	interface	NOUN
ecletica-1369	183	12	can	can	AUX
ecletica-1369	183	13	also	also	ADV
ecletica-1369	183	14	affect	affect	VERB
ecletica-1369	183	15	the	the	DET
ecletica-1369	183	16	voc	voc	NOUN
ecletica-1369	183	17	value	value	NOUN
ecletica-1369	183	18	(	(	PUNCT
ecletica-1369	183	19	günes	güne	NOUN
ecletica-1369	183	20	et	et	NOUN
ecletica-1369	183	21	al	al	PROPN
ecletica-1369	183	22	.	.	PROPN
ecletica-1369	183	23	,	,	PUNCT
ecletica-1369	183	24	2007	2007	NUM
ecletica-1369	183	25	)	)	PUNCT
ecletica-1369	183	26	.	.	PUNCT
ecletica-1369	184	1	finally	finally	ADV
ecletica-1369	184	2	,	,	PUNCT
ecletica-1369	184	3	this	this	DET
ecletica-1369	184	4	value	value	NOUN
ecletica-1369	184	5	decreases	decrease	VERB
ecletica-1369	184	6	with	with	ADP
ecletica-1369	184	7	temperature	temperature	NOUN
ecletica-1369	184	8	and	and	CCONJ
ecletica-1369	184	9	varies	vary	VERB
ecletica-1369	184	10	little	little	ADJ
ecletica-1369	184	11	with	with	ADP
ecletica-1369	184	12	light	light	ADJ
ecletica-1369	184	13	intensity	intensity	NOUN
ecletica-1369	184	14	(	(	PUNCT
ecletica-1369	184	15	oukachmih	oukachmih	PROPN
ecletica-1369	184	16	,	,	PUNCT
ecletica-1369	184	17	2003	2003	NUM
ecletica-1369	184	18	)	)	PUNCT
ecletica-1369	184	19	.	.	PUNCT
ecletica-1369	185	1	the	the	DET
ecletica-1369	185	2	energy	energy	NOUN
ecletica-1369	185	3	levels	level	NOUN
ecletica-1369	185	4	,	,	PUNCT
ecletica-1369	185	5	voc	voc	NOUN
ecletica-1369	185	6	and	and	CCONJ
ecletica-1369	185	7	α	α	NOUN
ecletica-1369	185	8	of	of	ADP
ecletica-1369	185	9	the	the	DET
ecletica-1369	185	10	studied	study	VERB
ecletica-1369	185	11	systems	system	NOUN
ecletica-1369	185	12	obtained	obtain	VERB
ecletica-1369	185	13	by	by	ADP
ecletica-1369	185	14	the	the	DET
ecletica-1369	185	15	dft	dft	PROPN
ecletica-1369	185	16	method	method	NOUN
ecletica-1369	185	17	are	be	AUX
ecletica-1369	185	18	shown	show	VERB
ecletica-1369	185	19	in	in	ADP
ecletica-1369	185	20	fig	fig	NOUN
ecletica-1369	185	21	.	.	PUNCT
ecletica-1369	186	1	17	17	NUM
ecletica-1369	186	2	.	.	X
ecletica-1369	186	3	figure	figure	NOUN
ecletica-1369	186	4	17	17	NUM
ecletica-1369	186	5	.	.	PUNCT
ecletica-1369	187	1	illustration	illustration	NOUN
ecletica-1369	187	2	of	of	ADP
ecletica-1369	187	3	the	the	DET
ecletica-1369	187	4	energy	energy	NOUN
ecletica-1369	187	5	levels	level	NOUN
ecletica-1369	187	6	and	and	CCONJ
ecletica-1369	187	7	voc	voc	NOUN
ecletica-1369	187	8	and	and	CCONJ
ecletica-1369	187	9	α	α	NOUN
ecletica-1369	187	10	of	of	ADP
ecletica-1369	187	11	the	the	DET
ecletica-1369	187	12	studied	study	VERB
ecletica-1369	187	13	systems	system	NOUN
ecletica-1369	187	14	obtained	obtain	VERB
ecletica-1369	187	15	by	by	ADP
ecletica-1369	187	16	the	the	DET
ecletica-1369	187	17	dft	dft	PROPN
ecletica-1369	187	18	method	method	NOUN
ecletica-1369	187	19	.	.	PUNCT
ecletica-1369	188	1	the	the	DET
ecletica-1369	188	2	theoretical	theoretical	ADJ
ecletica-1369	188	3	values	value	NOUN
ecletica-1369	188	4	of	of	ADP
ecletica-1369	188	5	the	the	DET
ecletica-1369	188	6	voc	voc	NOUN
ecletica-1369	188	7	of	of	ADP
ecletica-1369	188	8	the	the	DET
ecletica-1369	188	9	studied	study	VERB
ecletica-1369	188	10	systems	system	NOUN
ecletica-1369	188	11	are	be	AUX
ecletica-1369	188	12	ranked	rank	VERB
ecletica-1369	188	13	from	from	ADP
ecletica-1369	188	14	0.53	0.53	NUM
ecletica-1369	188	15	to	to	ADP
ecletica-1369	188	16	1.15	1.15	NUM
ecletica-1369	188	17	ev	ev	INTJ
ecletica-1369	188	18	taking	take	VERB
ecletica-1369	188	19	bispcbm	bispcbm	VERB
ecletica-1369	188	20	within	within	ADP
ecletica-1369	188	21	the	the	DET
ecletica-1369	188	22	solar	solar	ADJ
ecletica-1369	188	23	cell	cell	NOUN
ecletica-1369	188	24	as	as	ADP
ecletica-1369	188	25	the	the	DET
ecletica-1369	188	26	semiconductor	semiconductor	NOUN
ecletica-1369	188	27	acceptor	acceptor	NOUN
ecletica-1369	188	28	.	.	PUNCT
ecletica-1369	189	1	the	the	DET
ecletica-1369	189	2	crv	crv	PROPN
ecletica-1369	189	3	-	-	PUNCT
ecletica-1369	189	4	pp	pp	PROPN
ecletica-1369	189	5	,	,	PUNCT
ecletica-1369	189	6	crv	crv	PROPN
ecletica-1369	189	7	-	-	PUNCT
ecletica-1369	189	8	ttn	ttn	PROPN
ecletica-1369	189	9	,	,	PUNCT
ecletica-1369	189	10	and	and	CCONJ
ecletica-1369	189	11	crv	crv	PROPN
ecletica-1369	189	12	-	-	PUNCT
ecletica-1369	189	13	bbt	bbt	PROPN
ecletica-1369	189	14	systems	system	NOUN
ecletica-1369	189	15	exhibit	exhibit	VERB
ecletica-1369	189	16	large	large	ADJ
ecletica-1369	189	17	open	open	ADJ
ecletica-1369	189	18	-	-	PUNCT
ecletica-1369	189	19	circuit	circuit	NOUN
ecletica-1369	189	20	voltage	voltage	NOUN
ecletica-1369	189	21	values	value	NOUN
ecletica-1369	189	22	and	and	CCONJ
ecletica-1369	189	23	low	low	ADJ
ecletica-1369	189	24	α	α	PROPN
ecletica-1369	189	25	values	value	NOUN
ecletica-1369	189	26	.	.	PUNCT
ecletica-1369	190	1	consequently	consequently	ADV
ecletica-1369	190	2	,	,	PUNCT
ecletica-1369	190	3	the	the	PRON
ecletica-1369	190	4	lower	low	ADJ
ecletica-1369	190	5	the	the	DET
ecletica-1369	190	6	α	α	PROPN
ecletica-1369	190	7	values	value	NOUN
ecletica-1369	190	8	the	the	PRON
ecletica-1369	190	9	greater	great	ADJ
ecletica-1369	190	10	the	the	DET
ecletica-1369	190	11	electron	electron	NOUN
ecletica-1369	190	12	transfer	transfer	NOUN
ecletica-1369	190	13	from	from	ADP
ecletica-1369	190	14	the	the	DET
ecletica-1369	190	15	donor	donor	NOUN
ecletica-1369	190	16	lumo	lumo	NOUN
ecletica-1369	190	17	levels	level	NOUN
ecletica-1369	190	18	to	to	ADP
ecletica-1369	190	19	the	the	DET
ecletica-1369	190	20	acceptor	acceptor	NOUN
ecletica-1369	190	21	lumo	lumo	NOUN
ecletica-1369	190	22	levels	level	NOUN
ecletica-1369	190	23	.	.	PUNCT
ecletica-1369	191	1	4	4	X
ecletica-1369	191	2	.	.	X
ecletica-1369	191	3	conclusions	conclusion	NOUN
ecletica-1369	191	4	in	in	ADP
ecletica-1369	191	5	this	this	DET
ecletica-1369	191	6	work	work	NOUN
ecletica-1369	191	7	,	,	PUNCT
ecletica-1369	191	8	the	the	DET
ecletica-1369	191	9	addition	addition	NOUN
ecletica-1369	191	10	of	of	ADP
ecletica-1369	191	11	r	r	NOUN
ecletica-1369	191	12	=	=	SYM
ecletica-1369	191	13	t	t	PROPN
ecletica-1369	191	14	,	,	PUNCT
ecletica-1369	191	15	pt	pt	PROPN
ecletica-1369	191	16	,	,	PUNCT
ecletica-1369	191	17	pp	pp	PROPN
ecletica-1369	191	18	,	,	PUNCT
ecletica-1369	191	19	ttn	ttn	PROPN
ecletica-1369	191	20	,	,	PUNCT
ecletica-1369	191	21	and	and	CCONJ
ecletica-1369	191	22	bbt	bbt	PROPN
ecletica-1369	191	23	radical	radical	PROPN
ecletica-1369	191	24	to	to	ADP
ecletica-1369	191	25	crv	crv	PROPN
ecletica-1369	191	26	to	to	PART
ecletica-1369	191	27	improve	improve	VERB
ecletica-1369	191	28	the	the	DET
ecletica-1369	191	29	electronic	electronic	ADJ
ecletica-1369	191	30	properties	property	NOUN
ecletica-1369	191	31	for	for	ADP
ecletica-1369	191	32	uses	use	NOUN
ecletica-1369	191	33	in	in	ADP
ecletica-1369	191	34	solar	solar	ADJ
ecletica-1369	191	35	energy	energy	NOUN
ecletica-1369	191	36	conversion	conversion	NOUN
ecletica-1369	191	37	devices	device	NOUN
ecletica-1369	191	38	was	be	AUX
ecletica-1369	191	39	analyzed	analyze	VERB
ecletica-1369	191	40	.	.	PUNCT
ecletica-1369	192	1	thus	thus	ADV
ecletica-1369	192	2	,	,	PUNCT
ecletica-1369	192	3	the	the	DET
ecletica-1369	192	4	result	result	NOUN
ecletica-1369	192	5	of	of	ADP
ecletica-1369	192	6	long	long	ADJ
ecletica-1369	192	7	conjugated	conjugated	ADJ
ecletica-1369	192	8	chain	chain	NOUN
ecletica-1369	192	9	structures	structure	NOUN
ecletica-1369	192	10	,	,	PUNCT
ecletica-1369	192	11	a	a	DET
ecletica-1369	192	12	decrease	decrease	NOUN
ecletica-1369	192	13	in	in	ADP
ecletica-1369	192	14	gap	gap	NOUN
ecletica-1369	192	15	energy	energy	NOUN
ecletica-1369	192	16	and	and	CCONJ
ecletica-1369	192	17	a	a	DET
ecletica-1369	192	18	high	high	ADJ
ecletica-1369	192	19	dipole	dipole	NOUN
ecletica-1369	192	20	moment	moment	NOUN
ecletica-1369	192	21	,	,	PUNCT
ecletica-1369	192	22	has	have	VERB
ecletica-1369	192	23	a	a	DET
ecletica-1369	192	24	considerable	considerable	ADJ
ecletica-1369	192	25	influence	influence	NOUN
ecletica-1369	192	26	on	on	ADP
ecletica-1369	192	27	a	a	DET
ecletica-1369	192	28	charge	charge	NOUN
ecletica-1369	192	29	transfer	transfer	NOUN
ecletica-1369	192	30	which	which	PRON
ecletica-1369	192	31	is	be	AUX
ecletica-1369	192	32	the	the	DET
ecletica-1369	192	33	main	main	ADJ
ecletica-1369	192	34	link	link	NOUN
ecletica-1369	192	35	of	of	ADP
ecletica-1369	192	36	this	this	DET
ecletica-1369	192	37	conversion	conversion	NOUN
ecletica-1369	192	38	.	.	PUNCT
ecletica-1369	193	1	however	however	ADV
ecletica-1369	193	2	,	,	PUNCT
ecletica-1369	193	3	this	this	DET
ecletica-1369	193	4	study	study	NOUN
ecletica-1369	193	5	shows	show	VERB
ecletica-1369	193	6	that	that	SCONJ
ecletica-1369	193	7	systems	system	NOUN
ecletica-1369	193	8	with	with	ADP
ecletica-1369	193	9	a	a	DET
ecletica-1369	193	10	smaller	small	ADJ
ecletica-1369	193	11	energy	energy	NOUN
ecletica-1369	193	12	gap	gap	NOUN
ecletica-1369	193	13	,	,	PUNCT
ecletica-1369	193	14	precisely	precisely	ADV
ecletica-1369	193	15	for	for	ADP
ecletica-1369	193	16	the	the	DET
ecletica-1369	193	17	oligomers	oligomer	NOUN
ecletica-1369	193	18	crvbbt	crvbbt	NOUN
ecletica-1369	193	19	,	,	PUNCT
ecletica-1369	193	20	crv	crv	PROPN
ecletica-1369	193	21	-	-	PUNCT
ecletica-1369	193	22	ttn	ttn	PROPN
ecletica-1369	193	23	,	,	PUNCT
ecletica-1369	193	24	are	be	AUX
ecletica-1369	193	25	able	able	ADJ
ecletica-1369	193	26	to	to	PART
ecletica-1369	193	27	absorb	absorb	VERB
ecletica-1369	193	28	sunlight	sunlight	NOUN
ecletica-1369	193	29	in	in	ADP
ecletica-1369	193	30	the	the	DET
ecletica-1369	193	31	visible	visible	ADJ
ecletica-1369	193	32	range	range	NOUN
ecletica-1369	193	33	and	and	CCONJ
ecletica-1369	193	34	the	the	DET
ecletica-1369	193	35	conversion	conversion	NOUN
ecletica-1369	193	36	into	into	ADP
ecletica-1369	193	37	electricity	electricity	NOUN
ecletica-1369	193	38	is	be	AUX
ecletica-1369	193	39	thus	thus	ADV
ecletica-1369	193	40	ensured	ensure	VERB
ecletica-1369	193	41	.	.	PUNCT
ecletica-1369	194	1	this	this	DET
ecletica-1369	194	2	property	property	NOUN
ecletica-1369	194	3	allows	allow	VERB
ecletica-1369	194	4	these	these	DET
ecletica-1369	194	5	systems	system	NOUN
ecletica-1369	194	6	(	(	PUNCT
ecletica-1369	194	7	crv	crv	PROPN
ecletica-1369	194	8	-	-	PUNCT
ecletica-1369	194	9	bbt	bbt	PROPN
ecletica-1369	194	10	,	,	PUNCT
ecletica-1369	194	11	crvttn	crvttn	NOUN
ecletica-1369	194	12	)	)	PUNCT
ecletica-1369	194	13	to	to	PART
ecletica-1369	194	14	be	be	AUX
ecletica-1369	194	15	used	use	VERB
ecletica-1369	194	16	to	to	PART
ecletica-1369	194	17	produce	produce	VERB
ecletica-1369	194	18	and	and	CCONJ
ecletica-1369	194	19	manufacture	manufacture	VERB
ecletica-1369	194	20	electronic	electronic	ADJ
ecletica-1369	194	21	devices	device	NOUN
ecletica-1369	194	22	such	such	ADJ
ecletica-1369	194	23	as	as	ADP
ecletica-1369	194	24	photovoltaic	photovoltaic	NOUN
ecletica-1369	194	25	cells	cell	NOUN
ecletica-1369	194	26	.	.	PUNCT
ecletica-1369	195	1	considering	consider	VERB
ecletica-1369	195	2	the	the	DET
ecletica-1369	195	3	ea	ea	PROPN
ecletica-1369	195	4	–	–	PUNCT
ecletica-1369	195	5	(	(	PUNCT
ecletica-1369	195	6	electron	electron	NOUN
ecletica-1369	195	7	affinity	affinity	NOUN
ecletica-1369	195	8	)	)	PUNCT
ecletica-1369	195	9	and	and	CCONJ
ecletica-1369	195	10	ip	ip	NOUN
ecletica-1369	195	11	(	(	PUNCT
ecletica-1369	195	12	ionization	ionization	NOUN
ecletica-1369	195	13	potential	potential	NOUN
ecletica-1369	195	14	)	)	PUNCT
ecletica-1369	195	15	values	value	NOUN
ecletica-1369	195	16	,	,	PUNCT
ecletica-1369	195	17	it	it	PRON
ecletica-1369	195	18	is	be	AUX
ecletica-1369	195	19	believed	believe	VERB
ecletica-1369	195	20	that	that	SCONJ
ecletica-1369	195	21	the	the	DET
ecletica-1369	195	22	systems	system	NOUN
ecletica-1369	195	23	with	with	ADP
ecletica-1369	195	24	r	r	PROPN
ecletica-1369	195	25	=	=	SYM
ecletica-1369	195	26	bbt	bbt	PROPN
ecletica-1369	195	27	,	,	PUNCT
ecletica-1369	195	28	ttn	ttn	PROPN
ecletica-1369	195	29	groupings	grouping	NOUN
ecletica-1369	195	30	can	can	AUX
ecletica-1369	195	31	be	be	AUX
ecletica-1369	195	32	used	use	VERB
ecletica-1369	195	33	as	as	ADP
ecletica-1369	195	34	better	well	ADJ
ecletica-1369	195	35	organic	organic	ADJ
ecletica-1369	195	36	semiconductor	semiconductor	NOUN
ecletica-1369	195	37	materials	material	NOUN
ecletica-1369	195	38	,	,	PUNCT
ecletica-1369	195	39	for	for	ADP
ecletica-1369	195	40	donor	donor	NOUN
ecletica-1369	195	41	-	-	PUNCT
ecletica-1369	195	42	π	π	NOUN
ecletica-1369	195	43	-	-	NOUN
ecletica-1369	195	44	acceptor	acceptor	NOUN
ecletica-1369	195	45	-	-	PUNCT
ecletica-1369	195	46	acceptor	acceptor	NOUN
ecletica-1369	195	47	(	(	PUNCT
ecletica-1369	195	48	d	d	PROPN
ecletica-1369	195	49	-	-	PUNCT
ecletica-1369	195	50	π	π	NOUN
ecletica-1369	195	51	-	-	PUNCT
ecletica-1369	195	52	a	a	PRON
ecletica-1369	195	53	)	)	PUNCT
ecletica-1369	195	54	type	type	NOUN
ecletica-1369	195	55	devices	device	NOUN
ecletica-1369	195	56	.	.	PUNCT
ecletica-1369	196	1	authors	author	NOUN
ecletica-1369	196	2	’	’	PART
ecletica-1369	196	3	contribution	contribution	NOUN
ecletica-1369	196	4	conceptualization	conceptualization	NOUN
ecletica-1369	196	5	:	:	PUNCT
ecletica-1369	196	6	jabha	jabha	NOUN
ecletica-1369	196	7	,	,	PUNCT
ecletica-1369	196	8	m.	m.	NOUN
ecletica-1369	196	9	;	;	PUNCT
ecletica-1369	196	10	elalaoui	elalaoui	ADJ
ecletica-1369	196	11	,	,	PUNCT
ecletica-1369	196	12	a.	a.	PROPN
ecletica-1369	196	13	;	;	PUNCT
ecletica-1369	196	14	jarid	jarid	PROPN
ecletica-1369	196	15	a.	a.	NOUN
ecletica-1369	196	16	data	data	PROPN
ecletica-1369	196	17	curation	curation	NOUN
ecletica-1369	196	18	:	:	PUNCT
ecletica-1369	196	19	jabha	jabha	PROPN
ecletica-1369	196	20	,	,	PUNCT
ecletica-1369	196	21	m.	m.	NOUN
ecletica-1369	196	22	formal	formal	ADJ
ecletica-1369	196	23	analysis	analysis	NOUN
ecletica-1369	196	24	:	:	PUNCT
ecletica-1369	196	25	jabha	jabha	NOUN
ecletica-1369	196	26	,	,	PUNCT
ecletica-1369	196	27	m.	m.	NOUN
ecletica-1369	196	28	funding	funding	NOUN
ecletica-1369	196	29	acquisition	acquisition	NOUN
ecletica-1369	196	30	:	:	PUNCT
ecletica-1369	196	31	not	not	PART
ecletica-1369	196	32	applicable	applicable	ADJ
ecletica-1369	196	33	investigation	investigation	NOUN
ecletica-1369	196	34	:	:	PUNCT
ecletica-1369	196	35	jabha	jabha	PROPN
ecletica-1369	196	36	,	,	PUNCT
ecletica-1369	196	37	m.	m.	NOUN
ecletica-1369	196	38	;	;	PUNCT
ecletica-1369	196	39	mabrouk	mabrouk	PROPN
ecletica-1369	196	40	.	.	PUNCT
ecletica-1369	197	1	e.	e.	PROPN
ecletica-1369	197	2	h.	h.	PROPN
ecletica-1369	197	3	methodology	methodology	PROPN
ecletica-1369	197	4	:	:	PUNCT
ecletica-1369	197	5	jabha	jabha	PROPN
ecletica-1369	197	6	,	,	PUNCT
ecletica-1369	197	7	m.	m.	NOUN
ecletica-1369	197	8	;	;	PUNCT
ecletica-1369	197	9	elalaoui	elalaoui	ADJ
ecletica-1369	197	10	,	,	PUNCT
ecletica-1369	197	11	a.	a.	NOUN
ecletica-1369	197	12	;	;	PUNCT
ecletica-1369	197	13	jarid	jarid	PROPN
ecletica-1369	197	14	,	,	PUNCT
ecletica-1369	197	15	a.	a.	NOUN
ecletica-1369	197	16	project	project	PROPN
ecletica-1369	197	17	administration	administration	NOUN
ecletica-1369	197	18	:	:	PUNCT
ecletica-1369	198	1	elalaoui	elalaoui	ADJ
ecletica-1369	198	2	,	,	PUNCT
ecletica-1369	198	3	a.	a.	NOUN
ecletica-1369	198	4	resources	resource	NOUN
ecletica-1369	198	5	:	:	PUNCT
ecletica-1369	198	6	not	not	PART
ecletica-1369	198	7	applicable	applicable	ADJ
ecletica-1369	198	8	software	software	NOUN
ecletica-1369	198	9	:	:	PUNCT
ecletica-1369	198	10	not	not	PART
ecletica-1369	198	11	applicable	applicable	ADJ
ecletica-1369	198	12	supervision	supervision	NOUN
ecletica-1369	198	13	:	:	PUNCT
ecletica-1369	198	14	elalaoui	elalaoui	ADJ
ecletica-1369	198	15	a.	a.	PROPN
ecletica-1369	198	16	;	;	PUNCT
ecletica-1369	198	17	jarid	jarid	PROPN
ecletica-1369	198	18	a.	a.	NOUN
ecletica-1369	198	19	validation	validation	NOUN
ecletica-1369	198	20	:	:	PUNCT
ecletica-1369	199	1	elalaoui	elalaoui	ADJ
ecletica-1369	199	2	,	,	PUNCT
ecletica-1369	199	3	a.	a.	PROPN
ecletica-1369	199	4	;	;	PUNCT
ecletica-1369	199	5	jarid	jarid	PROPN
ecletica-1369	199	6	a.	a.	NOUN
ecletica-1369	199	7	;	;	PUNCT
ecletica-1369	199	8	mabrouk	mabrouk	PROPN
ecletica-1369	199	9	,	,	PUNCT
ecletica-1369	199	10	e.	e.	PROPN
ecletica-1369	199	11	h.	h.	PROPN
ecletica-1369	199	12	visualization	visualization	PROPN
ecletica-1369	199	13	:	:	PUNCT
ecletica-1369	199	14	elalaoui	elalaoui	ADJ
ecletica-1369	199	15	,	,	PUNCT
ecletica-1369	199	16	a.	a.	NOUN
ecletica-1369	199	17	;	;	PUNCT
ecletica-1369	199	18	jarid	jarid	VERB
ecletica-1369	199	19	,	,	PUNCT
ecletica-1369	199	20	a.	a.	NOUN
ecletica-1369	199	21	writing	writing	NOUN
ecletica-1369	199	22	–	–	PUNCT
ecletica-1369	199	23	original	original	ADJ
ecletica-1369	199	24	draft	draft	NOUN
ecletica-1369	199	25	:	:	PUNCT
ecletica-1369	199	26	jabha	jabha	NOUN
ecletica-1369	199	27	,	,	PUNCT
ecletica-1369	199	28	m.	m.	NOUN
ecletica-1369	199	29	writing	writing	NOUN
ecletica-1369	199	30	–	–	PUNCT
ecletica-1369	199	31	review	review	NOUN
ecletica-1369	199	32	&	&	CCONJ
ecletica-1369	199	33	editing	editing	NOUN
ecletica-1369	199	34	:	:	PUNCT
ecletica-1369	199	35	jabha	jabha	NOUN
ecletica-1369	199	36	,	,	PUNCT
ecletica-1369	199	37	m.	m.	NOUN
ecletica-1369	199	38	;	;	PUNCT
ecletica-1369	199	39	jarid	jarid	PROPN
ecletica-1369	199	40	,	,	PUNCT
ecletica-1369	199	41	a.	a.	NOUN
ecletica-1369	199	42	data	data	PROPN
ecletica-1369	199	43	availability	availability	NOUN
ecletica-1369	199	44	statement	statement	NOUN
ecletica-1369	199	45	all	all	DET
ecletica-1369	199	46	data	datum	NOUN
ecletica-1369	199	47	sets	set	NOUN
ecletica-1369	199	48	were	be	AUX
ecletica-1369	199	49	generated	generate	VERB
ecletica-1369	199	50	and	and	CCONJ
ecletica-1369	199	51	analyzed	analyze	VERB
ecletica-1369	199	52	in	in	ADP
ecletica-1369	199	53	the	the	DET
ecletica-1369	199	54	current	current	ADJ
ecletica-1369	199	55	study	study	NOUN
ecletica-1369	199	56	.	.	PUNCT
ecletica-1369	200	1	funding	funding	NOUN
ecletica-1369	200	2	not	not	PART
ecletica-1369	200	3	applicable	applicable	ADJ
ecletica-1369	200	4	acknowledgments	acknowledgment	NOUN
ecletica-1369	200	5	the	the	DET
ecletica-1369	200	6	authors	author	NOUN
ecletica-1369	200	7	are	be	AUX
ecletica-1369	200	8	grateful	grateful	ADJ
ecletica-1369	200	9	to	to	ADP
ecletica-1369	200	10	the	the	DET
ecletica-1369	200	11	“	"	PUNCT
ecletica-1369	200	12	association	association	NOUN
ecletica-1369	200	13	marocaine	marocaine	PROPN
ecletica-1369	200	14	des	des	PROPN
ecletica-1369	200	15	chimistes	chimistes	PROPN
ecletica-1369	200	16	théoriciens	théoricien	NOUN
ecletica-1369	200	17	”	"	PUNCT
ecletica-1369	200	18	(	(	PUNCT
ecletica-1369	200	19	amct	amct	ADJ
ecletica-1369	200	20	)	)	PUNCT
ecletica-1369	200	21	for	for	ADP
ecletica-1369	200	22	its	its	PRON
ecletica-1369	200	23	pertinent	pertinent	ADJ
ecletica-1369	200	24	help	help	NOUN
ecletica-1369	200	25	concerning	concern	VERB
ecletica-1369	200	26	the	the	DET
ecletica-1369	200	27	programs	program	NOUN
ecletica-1369	200	28	.	.	PUNCT
ecletica-1369	201	1	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	201	2	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	VERB
ecletica-1369	201	3	original	original	ADJ
ecletica-1369	201	4	article	article	NOUN
ecletica-1369	201	5	revista.iq.unesp.br	revista.iq.unesp.br	PROPN
ecletica-1369	201	6	67	67	NUM
ecletica-1369	201	7	eclética	eclética	PROPN
ecletica-1369	201	8	química	química	PROPN
ecletica-1369	201	9	journal	journal	PROPN
ecletica-1369	201	10	,	,	PUNCT
ecletica-1369	201	11	vol	vol	NOUN
ecletica-1369	201	12	.	.	PROPN
ecletica-1369	201	13	47	47	NUM
ecletica-1369	201	14	,	,	PUNCT
ecletica-1369	201	15	n.	n.	NOUN
ecletica-1369	201	16	4	4	NUM
ecletica-1369	201	17	,	,	PUNCT
ecletica-1369	201	18	2022	2022	NUM
ecletica-1369	201	19	,	,	PUNCT
ecletica-1369	201	20	55	55	NUM
ecletica-1369	201	21	-	-	SYM
ecletica-1369	201	22	68	68	NUM
ecletica-1369	201	23	issn	issn	NOUN
ecletica-1369	201	24	:	:	PUNCT
ecletica-1369	201	25	1678	1678	NUM
ecletica-1369	201	26	-	-	SYM
ecletica-1369	201	27	4618	4618	NUM
ecletica-1369	201	28	doi	doi	NOUN
ecletica-1369	201	29	:	:	PUNCT
ecletica-1369	201	30	10.26850/1678	10.26850/1678	NUM
ecletica-1369	201	31	-	-	SYM
ecletica-1369	201	32	4618eqj.v47.4.2022.p55	4618eqj.v47.4.2022.p55	NUM
ecletica-1369	201	33	-	-	PUNCT
ecletica-1369	201	34	68	68	NUM
ecletica-1369	201	35	references	reference	NOUN
ecletica-1369	201	36	aly	aly	PROPN
ecletica-1369	201	37	,	,	PUNCT
ecletica-1369	201	38	s.	s.	PROPN
ecletica-1369	201	39	m.	m.	PROPN
ecletica-1369	201	40	b.	b.	PROPN
ecletica-1369	201	41	transfert	transfert	PROPN
ecletica-1369	201	42	d'électron	d'électron	PROPN
ecletica-1369	201	43	et	et	NOUN
ecletica-1369	201	44	d’énergie	d’énergie	NOUN
ecletica-1369	201	45	photo	photo	NOUN
ecletica-1369	201	46	-	-	PUNCT
ecletica-1369	201	47	induits	induit	NOUN
ecletica-1369	201	48	dans	dan	NOUN
ecletica-1369	201	49	les	le	NOUN
ecletica-1369	201	50	polyads	polyad	NOUN
ecletica-1369	201	51	,	,	PUNCT
ecletica-1369	201	52	oligomères	oligomère	NOUN
ecletica-1369	201	53	et	et	PROPN
ecletica-1369	201	54	polymères	polymère	VERB
ecletica-1369	201	55	organiques	organique	NOUN
ecletica-1369	201	56	et	et	PROPN
ecletica-1369	201	57	organométalliques	organométallique	NOUN
ecletica-1369	201	58	.	.	PUNCT
ecletica-1369	202	1	ph.d	ph.d	PROPN
ecletica-1369	202	2	.	.	PUNCT
ecletica-1369	203	1	thesis	thesis	NOUN
ecletica-1369	203	2	,	,	PUNCT
ecletica-1369	203	3	university	university	NOUN
ecletica-1369	203	4	of	of	ADP
ecletica-1369	203	5	sherbrooke	sherbrooke	PROPN
ecletica-1369	203	6	,	,	PUNCT
ecletica-1369	203	7	2009	2009	NUM
ecletica-1369	203	8	.	.	PUNCT
ecletica-1369	204	1	https://library-rchives.canada.ca/eng/services/serviceslibraries/theses/pages/item.aspx?idnumber=648383653	https://library-rchives.canada.ca/eng/services/serviceslibraries/theses/pages/item.aspx?idnumber=648383653	PROPN
ecletica-1369	204	2	(	(	PUNCT
ecletica-1369	204	3	accessed	access	VERB
ecletica-1369	204	4	2022	2022	NUM
ecletica-1369	204	5	-	-	SYM
ecletica-1369	204	6	06	06	NUM
ecletica-1369	204	7	-	-	SYM
ecletica-1369	204	8	15	15	NUM
ecletica-1369	204	9	)	)	PUNCT
ecletica-1369	204	10	andré	andré	NOUN
ecletica-1369	204	11	,	,	PUNCT
ecletica-1369	204	12	j.-m	j.-m	PROPN
ecletica-1369	204	13	.	.	PUNCT
ecletica-1369	205	1	;	;	PUNCT
ecletica-1369	205	2	brédas	bréda	NOUN
ecletica-1369	205	3	,	,	PUNCT
ecletica-1369	205	4	j.-l	j.-l	PROPN
ecletica-1369	205	5	.	.	PUNCT
ecletica-1369	206	1	transfert	transfert	PROPN
ecletica-1369	206	2	d’électrons	d’électrons	PROPN
ecletica-1369	206	3	:	:	PUNCT
ecletica-1369	206	4	des	des	PROPN
ecletica-1369	206	5	polymères	polymère	VERB
ecletica-1369	206	6	conducteurs	conducteur	VERB
ecletica-1369	206	7	d'électricité	d'électricité	PROPN
ecletica-1369	206	8	aux	aux	PROPN
ecletica-1369	206	9	diodes	diode	NOUN
ecletica-1369	206	10	organiques	organique	NOUN
ecletica-1369	206	11	électroluminescentes	électroluminescente	NOUN
ecletica-1369	206	12	ou	ou	X
ecletica-1369	206	13	une	une	PROPN
ecletica-1369	206	14	avalanche	avalanche	PROPN
ecletica-1369	206	15	de	de	PROPN
ecletica-1369	206	16	prix	prix	PROPN
ecletica-1369	206	17	nobel	nobel	PROPN
ecletica-1369	206	18	.	.	PUNCT
ecletica-1369	207	1	bull	bull	PROPN
ecletica-1369	207	2	.	.	PUNCT
ecletica-1369	208	1	acad	acad	PROPN
ecletica-1369	208	2	.	.	PUNCT
ecletica-1369	209	1	r.	r.	PROPN
ecletica-1369	209	2	belg	belg	PROPN
ecletica-1369	209	3	.	.	PUNCT
ecletica-1369	210	1	2002	2002	NUM
ecletica-1369	210	2	,	,	PUNCT
ecletica-1369	210	3	13	13	NUM
ecletica-1369	210	4	(	(	PUNCT
ecletica-1369	210	5	7	7	NUM
ecletica-1369	210	6	)	)	PUNCT
ecletica-1369	210	7	,	,	PUNCT
ecletica-1369	210	8	273–289	273–289	NUM
ecletica-1369	210	9	.	.	PUNCT
ecletica-1369	211	1	https://doi.org/10.3406/barb.2002.28296	https://doi.org/10.3406/barb.2002.28296	PROPN
ecletica-1369	211	2	baker	baker	PROPN
ecletica-1369	211	3	,	,	PUNCT
ecletica-1369	211	4	j.	j.	PROPN
ecletica-1369	211	5	;	;	PUNCT
ecletica-1369	211	6	andzelm	andzelm	PROPN
ecletica-1369	211	7	,	,	PUNCT
ecletica-1369	211	8	j.	j.	PROPN
ecletica-1369	211	9	;	;	PUNCT
ecletica-1369	211	10	muir	muir	PROPN
ecletica-1369	211	11	,	,	PUNCT
ecletica-1369	211	12	m.	m.	NOUN
ecletica-1369	211	13	;	;	PUNCT
ecletica-1369	211	14	taylor	taylor	PROPN
ecletica-1369	211	15	,	,	PUNCT
ecletica-1369	211	16	p.	p.	PROPN
ecletica-1369	211	17	r.	r.	PROPN
ecletica-1369	211	18	oh+h2→h2o+h	oh+h2→h2o+h	PROPN
ecletica-1369	211	19	.	.	PUNCT
ecletica-1369	212	1	the	the	DET
ecletica-1369	212	2	importance	importance	NOUN
ecletica-1369	212	3	of	of	ADP
ecletica-1369	212	4	‘	'	PUNCT
ecletica-1369	212	5	exact	exact	ADJ
ecletica-1369	212	6	exchange	exchange	NOUN
ecletica-1369	212	7	’	'	PUNCT
ecletica-1369	212	8	in	in	ADP
ecletica-1369	212	9	density	density	NOUN
ecletica-1369	212	10	functional	functional	ADJ
ecletica-1369	212	11	theory	theory	NOUN
ecletica-1369	212	12	.	.	PUNCT
ecletica-1369	213	1	chem	chem	NOUN
ecletica-1369	213	2	.	.	PUNCT
ecletica-1369	214	1	phys	phy	NOUN
ecletica-1369	214	2	.	.	PUNCT
ecletica-1369	215	1	lett	lett	PROPN
ecletica-1369	215	2	.	.	PUNCT
ecletica-1369	216	1	1995	1995	NUM
ecletica-1369	216	2	,	,	PUNCT
ecletica-1369	216	3	237	237	NUM
ecletica-1369	216	4	(	(	PUNCT
ecletica-1369	216	5	1–2	1–2	NUM
ecletica-1369	216	6	)	)	PUNCT
ecletica-1369	216	7	,	,	PUNCT
ecletica-1369	216	8	53–60	53–60	PROPN
ecletica-1369	216	9	.	.	PUNCT
ecletica-1369	217	1	https://doi.org/10.1016/0009-2614(95)00299-j	https://doi.org/10.1016/0009-2614(95)00299-j	PROPN
ecletica-1369	217	2	bally	bally	PROPN
ecletica-1369	217	3	,	,	PUNCT
ecletica-1369	217	4	t.	t.	PROPN
ecletica-1369	217	5	;	;	PUNCT
ecletica-1369	217	6	carrupt	carrupt	PROPN
ecletica-1369	217	7	,	,	PUNCT
ecletica-1369	217	8	p.-a	p.-a	PROPN
ecletica-1369	217	9	.	.	PUNCT
ecletica-1369	217	10	;	;	PUNCT
ecletica-1369	217	11	weber	weber	PROPN
ecletica-1369	217	12	,	,	PUNCT
ecletica-1369	217	13	j.	j.	PROPN
ecletica-1369	217	14	comparison	comparison	NOUN
ecletica-1369	217	15	of	of	ADP
ecletica-1369	217	16	the	the	DET
ecletica-1369	217	17	performances	performance	NOUN
ecletica-1369	217	18	of	of	ADP
ecletica-1369	217	19	the	the	DET
ecletica-1369	217	20	gaussian	gaussian	NOUN
ecletica-1369	217	21	and	and	CCONJ
ecletica-1369	217	22	cadpac	cadpac	NOUN
ecletica-1369	217	23	ab	ab	PROPN
ecletica-1369	217	24	initio	initio	PROPN
ecletica-1369	217	25	program	program	NOUN
ecletica-1369	217	26	packages	package	NOUN
ecletica-1369	217	27	on	on	ADP
ecletica-1369	217	28	different	different	ADJ
ecletica-1369	217	29	computers	computer	NOUN
ecletica-1369	217	30	.	.	PUNCT
ecletica-1369	218	1	chimia	chimia	NOUN
ecletica-1369	218	2	.	.	PUNCT
ecletica-1369	219	1	1991	1991	NUM
ecletica-1369	219	2	,	,	PUNCT
ecletica-1369	219	3	45	45	NUM
ecletica-1369	219	4	(	(	PUNCT
ecletica-1369	219	5	11	11	NUM
ecletica-1369	219	6	)	)	PUNCT
ecletica-1369	219	7	,	,	PUNCT
ecletica-1369	219	8	352–356	352–356	NUM
ecletica-1369	219	9	.	.	PUNCT
ecletica-1369	220	1	https://doi.org/10.2533/chimia.1991.352	https://doi.org/10.2533/chimia.1991.352	PROPN
ecletica-1369	220	2	baran	baran	NOUN
ecletica-1369	220	3	,	,	PUNCT
ecletica-1369	220	4	d.	d.	PROPN
ecletica-1369	220	5	;	;	PUNCT
ecletica-1369	220	6	ashraf	ashraf	PROPN
ecletica-1369	220	7	,	,	PUNCT
ecletica-1369	220	8	r.	r.	PROPN
ecletica-1369	220	9	s.	s.	PROPN
ecletica-1369	220	10	;	;	PUNCT
ecletica-1369	220	11	hanifi	hanifi	PROPN
ecletica-1369	220	12	,	,	PUNCT
ecletica-1369	220	13	d.	d.	PROPN
ecletica-1369	220	14	a.	a.	PROPN
ecletica-1369	220	15	;	;	PUNCT
ecletica-1369	220	16	abdelsamie	abdelsamie	ADV
ecletica-1369	220	17	,	,	PUNCT
ecletica-1369	220	18	m.	m.	NOUN
ecletica-1369	220	19	;	;	PUNCT
ecletica-1369	220	20	gasparini	gasparini	NOUN
ecletica-1369	220	21	,	,	PUNCT
ecletica-1369	220	22	n.	n.	PROPN
ecletica-1369	220	23	;	;	PUNCT
ecletica-1369	220	24	röhr	röhr	PROPN
ecletica-1369	220	25	,	,	PUNCT
ecletica-1369	220	26	j.	j.	PROPN
ecletica-1369	220	27	a.	a.	PROPN
ecletica-1369	220	28	;	;	PUNCT
ecletica-1369	220	29	holliday	holliday	PROPN
ecletica-1369	220	30	,	,	PUNCT
ecletica-1369	220	31	s.	s.	PROPN
ecletica-1369	220	32	;	;	PUNCT
ecletica-1369	220	33	wadsworth	wadsworth	PROPN
ecletica-1369	220	34	,	,	PUNCT
ecletica-1369	220	35	a.	a.	NOUN
ecletica-1369	220	36	;	;	PUNCT
ecletica-1369	220	37	lockett	lockett	PROPN
ecletica-1369	220	38	,	,	PUNCT
ecletica-1369	220	39	s.	s.	PROPN
ecletica-1369	220	40	;	;	PUNCT
ecletica-1369	220	41	neophytou	neophytou	PROPN
ecletica-1369	220	42	,	,	PUNCT
ecletica-1369	220	43	m.	m.	NOUN
ecletica-1369	220	44	;	;	PUNCT
ecletica-1369	220	45	emmott	emmott	PROPN
ecletica-1369	220	46	,	,	PUNCT
ecletica-1369	220	47	j.	j.	PROPN
ecletica-1369	220	48	m.	m.	PROPN
ecletica-1369	220	49	;	;	PUNCT
ecletica-1369	220	50	nelson	nelson	PROPN
ecletica-1369	220	51	,	,	PUNCT
ecletica-1369	220	52	j.	j.	PROPN
ecletica-1369	220	53	;	;	PUNCT
ecletica-1369	220	54	brabec	brabec	PROPN
ecletica-1369	220	55	,	,	PUNCT
ecletica-1369	220	56	c.	c.	PROPN
ecletica-1369	220	57	j.	j.	PROPN
ecletica-1369	220	58	;	;	PUNCT
ecletica-1369	220	59	amassian	amassian	PROPN
ecletica-1369	220	60	,	,	PUNCT
ecletica-1369	220	61	a.	a.	NOUN
ecletica-1369	220	62	;	;	PUNCT
ecletica-1369	220	63	salleo	salleo	PROPN
ecletica-1369	220	64	,	,	PUNCT
ecletica-1369	220	65	a.	a.	NOUN
ecletica-1369	220	66	;	;	PUNCT
ecletica-1369	220	67	kirchartz	kirchartz	PROPN
ecletica-1369	220	68	,	,	PUNCT
ecletica-1369	220	69	t.	t.	PROPN
ecletica-1369	220	70	;	;	PUNCT
ecletica-1369	220	71	james	james	PROPN
ecletica-1369	220	72	r.	r.	PROPN
ecletica-1369	220	73	durrant	durrant	PROPN
ecletica-1369	220	74	,	,	PUNCT
ecletica-1369	220	75	j.	j.	PROPN
ecletica-1369	220	76	r.	r.	PROPN
ecletica-1369	220	77	;	;	PUNCT
ecletica-1369	220	78	mcculloch	mcculloch	PROPN
ecletica-1369	220	79	,	,	PUNCT
ecletica-1369	220	80	i.	i.	PROPN
ecletica-1369	220	81	reducing	reduce	VERB
ecletica-1369	220	82	the	the	DET
ecletica-1369	220	83	efficiency	efficiency	NOUN
ecletica-1369	220	84	–	–	PUNCT
ecletica-1369	220	85	stability	stability	NOUN
ecletica-1369	220	86	–	–	PUNCT
ecletica-1369	220	87	cost	cost	NOUN
ecletica-1369	220	88	gap	gap	NOUN
ecletica-1369	220	89	of	of	ADP
ecletica-1369	220	90	organic	organic	ADJ
ecletica-1369	220	91	photovoltaics	photovoltaic	NOUN
ecletica-1369	220	92	with	with	ADP
ecletica-1369	220	93	highly	highly	ADV
ecletica-1369	220	94	efficient	efficient	ADJ
ecletica-1369	220	95	and	and	CCONJ
ecletica-1369	220	96	stable	stable	ADJ
ecletica-1369	220	97	small	small	ADJ
ecletica-1369	220	98	molecule	molecule	NOUN
ecletica-1369	220	99	acceptor	acceptor	NOUN
ecletica-1369	220	100	ternary	ternary	ADJ
ecletica-1369	220	101	solar	solar	ADJ
ecletica-1369	220	102	cells	cell	NOUN
ecletica-1369	220	103	.	.	PUNCT
ecletica-1369	221	1	nature	nature	NOUN
ecletica-1369	221	2	mater	mater	NOUN
ecletica-1369	221	3	.	.	PROPN
ecletica-1369	222	1	2017	2017	NUM
ecletica-1369	222	2	,	,	PUNCT
ecletica-1369	222	3	16	16	NUM
ecletica-1369	222	4	(	(	PUNCT
ecletica-1369	222	5	3	3	NUM
ecletica-1369	222	6	)	)	PUNCT
ecletica-1369	222	7	,	,	PUNCT
ecletica-1369	222	8	363–369	363–369	NUM
ecletica-1369	222	9	.	.	PUNCT
ecletica-1369	223	1	https://doi.org/10.1038/nmat4797	https://doi.org/10.1038/nmat4797	NOUN
ecletica-1369	223	2	becke	becke	NOUN
ecletica-1369	223	3	,	,	PUNCT
ecletica-1369	223	4	a.	a.	PROPN
ecletica-1369	223	5	d.	d.	PROPN
ecletica-1369	223	6	density	density	PROPN
ecletica-1369	223	7	-	-	PUNCT
ecletica-1369	223	8	functional	functional	ADJ
ecletica-1369	223	9	exchange	exchange	NOUN
ecletica-1369	223	10	-	-	PUNCT
ecletica-1369	223	11	energy	energy	NOUN
ecletica-1369	223	12	approximation	approximation	NOUN
ecletica-1369	223	13	with	with	ADP
ecletica-1369	223	14	correct	correct	ADJ
ecletica-1369	223	15	asymptotic	asymptotic	ADJ
ecletica-1369	223	16	behavior	behavior	NOUN
ecletica-1369	223	17	.	.	PUNCT
ecletica-1369	224	1	phys	phy	NOUN
ecletica-1369	224	2	.	.	PUNCT
ecletica-1369	225	1	rev	rev	PROPN
ecletica-1369	225	2	.	.	PUNCT
ecletica-1369	226	1	a	a	DET
ecletica-1369	226	2	1988	1988	NUM
ecletica-1369	226	3	,	,	PUNCT
ecletica-1369	226	4	38	38	NUM
ecletica-1369	226	5	(	(	PUNCT
ecletica-1369	226	6	6	6	NUM
ecletica-1369	226	7	)	)	PUNCT
ecletica-1369	226	8	,	,	PUNCT
ecletica-1369	226	9	3098	3098	NUM
ecletica-1369	226	10	.	.	PUNCT
ecletica-1369	227	1	https://doi.org/10.1103/physreva.38.3098	https://doi.org/10.1103/physreva.38.3098	PROPN
ecletica-1369	227	2	berlin	berlin	PROPN
ecletica-1369	227	3	,	,	PUNCT
ecletica-1369	227	4	y.	y.	PROPN
ecletica-1369	227	5	a.	a.	PROPN
ecletica-1369	227	6	;	;	PUNCT
ecletica-1369	227	7	hutchison	hutchison	PROPN
ecletica-1369	227	8	,	,	PUNCT
ecletica-1369	227	9	g.	g.	PROPN
ecletica-1369	227	10	r.	r.	PROPN
ecletica-1369	227	11	;	;	PUNCT
ecletica-1369	227	12	rempala	rempala	PROPN
ecletica-1369	227	13	,	,	PUNCT
ecletica-1369	227	14	p.	p.	NOUN
ecletica-1369	227	15	;	;	PUNCT
ecletica-1369	227	16	ratner	ratner	PROPN
ecletica-1369	227	17	,	,	PUNCT
ecletica-1369	227	18	m.	m.	NOUN
ecletica-1369	227	19	a.	a.	NOUN
ecletica-1369	227	20	;	;	PUNCT
ecletica-1369	227	21	michl	michl	PROPN
ecletica-1369	227	22	,	,	PUNCT
ecletica-1369	227	23	j.	j.	PROPN
ecletica-1369	227	24	charge	charge	NOUN
ecletica-1369	227	25	hopping	hop	VERB
ecletica-1369	227	26	in	in	ADP
ecletica-1369	227	27	molecular	molecular	ADJ
ecletica-1369	227	28	wires	wire	NOUN
ecletica-1369	227	29	as	as	ADP
ecletica-1369	227	30	a	a	DET
ecletica-1369	227	31	sequence	sequence	NOUN
ecletica-1369	227	32	of	of	ADP
ecletica-1369	227	33	electron	electron	NOUN
ecletica-1369	227	34	-	-	PUNCT
ecletica-1369	227	35	transfer	transfer	NOUN
ecletica-1369	227	36	reactions	reaction	NOUN
ecletica-1369	227	37	.	.	PUNCT
ecletica-1369	228	1	j.	j.	PROPN
ecletica-1369	228	2	phys	phys	PROPN
ecletica-1369	228	3	.	.	PUNCT
ecletica-1369	229	1	chem	chem	PROPN
ecletica-1369	229	2	.	.	PUNCT
ecletica-1369	230	1	a.	a.	PROPN
ecletica-1369	230	2	2003	2003	NUM
ecletica-1369	230	3	,	,	PUNCT
ecletica-1369	230	4	107	107	NUM
ecletica-1369	230	5	(	(	PUNCT
ecletica-1369	230	6	19	19	NUM
ecletica-1369	230	7	)	)	PUNCT
ecletica-1369	230	8	,	,	PUNCT
ecletica-1369	230	9	3970–3980	3970–3980	NUM
ecletica-1369	230	10	.	.	PUNCT
ecletica-1369	231	1	https://doi.org/10.1021/jp034225i	https://doi.org/10.1021/jp034225i	VERB
ecletica-1369	231	2	brabec	brabec	NOUN
ecletica-1369	231	3	,	,	PUNCT
ecletica-1369	231	4	c.	c.	PROPN
ecletica-1369	231	5	j.	j.	PROPN
ecletica-1369	231	6	;	;	PUNCT
ecletica-1369	231	7	cravino	cravino	PROPN
ecletica-1369	231	8	,	,	PUNCT
ecletica-1369	231	9	a.	a.	NOUN
ecletica-1369	231	10	;	;	PUNCT
ecletica-1369	231	11	meissner	meissner	PROPN
ecletica-1369	231	12	,	,	PUNCT
ecletica-1369	231	13	d.	d.	PROPN
ecletica-1369	231	14	;	;	PUNCT
ecletica-1369	231	15	sariciftci	sariciftci	PROPN
ecletica-1369	231	16	,	,	PUNCT
ecletica-1369	231	17	n.	n.	PROPN
ecletica-1369	231	18	s.	s.	PROPN
ecletica-1369	231	19	;	;	PUNCT
ecletica-1369	231	20	fromherz	fromherz	NOUN
ecletica-1369	231	21	,	,	PUNCT
ecletica-1369	231	22	t.	t.	PROPN
ecletica-1369	231	23	;	;	PUNCT
ecletica-1369	231	24	rispens	rispen	NOUN
ecletica-1369	231	25	,	,	PUNCT
ecletica-1369	231	26	m.	m.	NOUN
ecletica-1369	231	27	t.	t.	PROPN
ecletica-1369	231	28	;	;	PUNCT
ecletica-1369	231	29	sanchez	sanchez	PROPN
ecletica-1369	231	30	,	,	PUNCT
ecletica-1369	231	31	l.	l.	PROPN
ecletica-1369	231	32	;	;	PUNCT
ecletica-1369	231	33	hummelen	hummelen	PROPN
ecletica-1369	231	34	,	,	PUNCT
ecletica-1369	231	35	j.	j.	PROPN
ecletica-1369	231	36	c.	c.	PROPN
ecletica-1369	231	37	origin	origin	PROPN
ecletica-1369	231	38	of	of	ADP
ecletica-1369	231	39	the	the	DET
ecletica-1369	231	40	open	open	ADJ
ecletica-1369	231	41	circuit	circuit	NOUN
ecletica-1369	231	42	voltage	voltage	NOUN
ecletica-1369	231	43	of	of	ADP
ecletica-1369	231	44	plastic	plastic	ADJ
ecletica-1369	231	45	solar	solar	ADJ
ecletica-1369	231	46	cells	cell	NOUN
ecletica-1369	231	47	.	.	PUNCT
ecletica-1369	232	1	adv	adv	PROPN
ecletica-1369	232	2	.	.	PUNCT
ecletica-1369	232	3	funct	funct	PROPN
ecletica-1369	232	4	.	.	PUNCT
ecletica-1369	233	1	mater	mater	PROPN
ecletica-1369	233	2	.	.	PUNCT
ecletica-1369	234	1	2001	2001	NUM
ecletica-1369	234	2	,	,	PUNCT
ecletica-1369	234	3	11	11	NUM
ecletica-1369	234	4	(	(	PUNCT
ecletica-1369	234	5	5	5	NUM
ecletica-1369	234	6	)	)	PUNCT
ecletica-1369	234	7	,	,	PUNCT
ecletica-1369	235	1	374–380	374–380	NUM
ecletica-1369	235	2	.	.	PUNCT
ecletica-1369	236	1	https://doi.org/10.1002/1616-3028	https://doi.org/10.1002/1616-3028	PROPN
ecletica-1369	236	2	burke	burke	PROPN
ecletica-1369	236	3	,	,	PUNCT
ecletica-1369	236	4	k.	k.	PROPN
ecletica-1369	236	5	;	;	PUNCT
ecletica-1369	236	6	perdew	perdew	PROPN
ecletica-1369	236	7	,	,	PUNCT
ecletica-1369	236	8	j.	j.	PROPN
ecletica-1369	236	9	p.	p.	PROPN
ecletica-1369	236	10	;	;	PUNCT
ecletica-1369	236	11	levy	levy	NOUN
ecletica-1369	236	12	,	,	PUNCT
ecletica-1369	236	13	m.	m.	NOUN
ecletica-1369	236	14	improving	improve	VERB
ecletica-1369	236	15	energies	energy	NOUN
ecletica-1369	236	16	by	by	ADP
ecletica-1369	236	17	using	use	VERB
ecletica-1369	236	18	exact	exact	ADJ
ecletica-1369	236	19	electron	electron	NOUN
ecletica-1369	236	20	densities	density	NOUN
ecletica-1369	236	21	.	.	PUNCT
ecletica-1369	237	1	phys	phy	NOUN
ecletica-1369	237	2	.	.	PUNCT
ecletica-1369	238	1	rev	rev	PROPN
ecletica-1369	238	2	.	.	PUNCT
ecletica-1369	238	3	a.	a.	PROPN
ecletica-1369	238	4	1996	1996	NUM
ecletica-1369	238	5	,	,	PUNCT
ecletica-1369	238	6	53	53	NUM
ecletica-1369	238	7	(	(	PUNCT
ecletica-1369	238	8	5	5	NUM
ecletica-1369	238	9	)	)	PUNCT
ecletica-1369	238	10	,	,	PUNCT
ecletica-1369	238	11	r2915	r2915	NOUN
ecletica-1369	238	12	.	.	PUNCT
ecletica-1369	239	1	https://doi.org/10.1103/physreva.53.r2915	https://doi.org/10.1103/physreva.53.r2915	PROPN
ecletica-1369	239	2	camara	camara	PROPN
ecletica-1369	239	3	,	,	PUNCT
ecletica-1369	239	4	m.	m.	NOUN
ecletica-1369	239	5	a.	a.	PROPN
ecletica-1369	239	6	modélisation	modélisation	PROPN
ecletica-1369	239	7	du	du	PROPN
ecletica-1369	239	8	stockage	stockage	PROPN
ecletica-1369	239	9	de	de	X
ecletica-1369	239	10	l’énergie	l’énergie	PROPN
ecletica-1369	239	11	photovoltaïque	photovoltaïque	PROPN
ecletica-1369	239	12	par	par	PROPN
ecletica-1369	239	13	supercondensateurs	supercondensateur	VERB
ecletica-1369	239	14	.	.	PUNCT
ecletica-1369	240	1	ph.d	ph.d	PROPN
ecletica-1369	240	2	.	.	PUNCT
ecletica-1369	241	1	thesis	thesis	NOUN
ecletica-1369	241	2	,	,	PUNCT
ecletica-1369	241	3	university	university	PROPN
ecletica-1369	241	4	of	of	ADP
ecletica-1369	241	5	paris	paris	PROPN
ecletica-1369	241	6	-	-	PUNCT
ecletica-1369	241	7	est	est	PROPN
ecletica-1369	241	8	,	,	PUNCT
ecletica-1369	241	9	france	france	PROPN
ecletica-1369	241	10	,	,	PUNCT
ecletica-1369	241	11	2011	2011	NUM
ecletica-1369	241	12	.	.	PUNCT
ecletica-1369	242	1	https://tel.archivesouvertes.fr/tel-00673218/	https://tel.archivesouvertes.fr/tel-00673218/	VERB
ecletica-1369	242	2	(	(	PUNCT
ecletica-1369	242	3	accessed	access	VERB
ecletica-1369	242	4	2022	2022	NUM
ecletica-1369	242	5	-	-	SYM
ecletica-1369	242	6	04	04	NUM
ecletica-1369	242	7	-	-	PUNCT
ecletica-1369	242	8	20	20	NUM
ecletica-1369	242	9	)	)	PUNCT
ecletica-1369	242	10	cheung	cheung	PROPN
ecletica-1369	242	11	,	,	PUNCT
ecletica-1369	242	12	d.	d.	PROPN
ecletica-1369	242	13	l.	l.	PROPN
ecletica-1369	242	14	;	;	PUNCT
ecletica-1369	242	15	troisi	troisi	PROPN
ecletica-1369	242	16	,	,	PUNCT
ecletica-1369	242	17	a.	a.	PROPN
ecletica-1369	242	18	theoretical	theoretical	ADJ
ecletica-1369	242	19	study	study	NOUN
ecletica-1369	242	20	of	of	ADP
ecletica-1369	242	21	the	the	DET
ecletica-1369	242	22	organic	organic	ADJ
ecletica-1369	242	23	photovoltaic	photovoltaic	NOUN
ecletica-1369	242	24	electron	electron	NOUN
ecletica-1369	242	25	acceptor	acceptor	NOUN
ecletica-1369	242	26	pcbm	pcbm	PROPN
ecletica-1369	242	27	:	:	PUNCT
ecletica-1369	242	28	morphology	morphology	NOUN
ecletica-1369	242	29	,	,	PUNCT
ecletica-1369	242	30	electronic	electronic	ADJ
ecletica-1369	242	31	structure	structure	NOUN
ecletica-1369	242	32	,	,	PUNCT
ecletica-1369	242	33	and	and	CCONJ
ecletica-1369	242	34	charge	charge	NOUN
ecletica-1369	242	35	localization	localization	NOUN
ecletica-1369	242	36	.	.	PUNCT
ecletica-1369	243	1	j.	j.	PROPN
ecletica-1369	243	2	phys	phys	PROPN
ecletica-1369	243	3	.	.	PUNCT
ecletica-1369	244	1	chem	chem	PROPN
ecletica-1369	244	2	.	.	PUNCT
ecletica-1369	245	1	c.	c.	PROPN
ecletica-1369	245	2	2010	2010	NUM
ecletica-1369	245	3	,	,	PUNCT
ecletica-1369	245	4	114	114	NUM
ecletica-1369	245	5	(	(	PUNCT
ecletica-1369	245	6	48	48	NUM
ecletica-1369	245	7	)	)	PUNCT
ecletica-1369	245	8	,	,	PUNCT
ecletica-1369	245	9	20479–20488	20479–20488	NUM
ecletica-1369	245	10	.	.	PUNCT
ecletica-1369	246	1	https://doi.org/10.1021/jp1049167	https://doi.org/10.1021/jp1049167	PROPN
ecletica-1369	246	2	dufil	dufil	PROPN
ecletica-1369	246	3	,	,	PUNCT
ecletica-1369	246	4	y.	y.	PROPN
ecletica-1369	246	5	monocouches	monocouche	NOUN
ecletica-1369	246	6	auto‐assemblées	auto‐assemblées	PROPN
ecletica-1369	246	7	et	et	PROPN
ecletica-1369	246	8	nanostructures	nanostructures	PROPN
ecletica-1369	246	9	de	de	ADP
ecletica-1369	246	10	métaux	métaux	PROPN
ecletica-1369	246	11	nobles	noble	NOUN
ecletica-1369	246	12	:	:	PUNCT
ecletica-1369	246	13	préparation	préparation	NOUN
ecletica-1369	246	14	et	et	NOUN
ecletica-1369	246	15	application	application	NOUN
ecletica-1369	246	16	au	au	ADP
ecletica-1369	246	17	photovoltaïque	photovoltaïque	PROPN
ecletica-1369	246	18	.	.	PUNCT
ecletica-1369	247	1	ph.d	ph.d	PROPN
ecletica-1369	247	2	.	.	PUNCT
ecletica-1369	248	1	dissertation	dissertation	NOUN
ecletica-1369	248	2	,	,	PUNCT
ecletica-1369	248	3	queen	queen	PROPN
ecletica-1369	248	4	’s	’s	PART
ecletica-1369	248	5	university	university	PROPN
ecletica-1369	248	6	and	and	CCONJ
ecletica-1369	248	7	university	university	PROPN
ecletica-1369	248	8	of	of	ADP
ecletica-1369	248	9	aix	aix	NOUN
ecletica-1369	248	10	-	-	PUNCT
ecletica-1369	248	11	marseille	marseille	NOUN
ecletica-1369	248	12	,	,	PUNCT
ecletica-1369	248	13	2018	2018	NUM
ecletica-1369	248	14	.	.	PUNCT
ecletica-1369	249	1	frisch	frisch	PROPN
ecletica-1369	249	2	,	,	PUNCT
ecletica-1369	249	3	m.	m.	NOUN
ecletica-1369	249	4	j.	j.	PROPN
ecletica-1369	249	5	;	;	PUNCT
ecletica-1369	249	6	pople	pople	PROPN
ecletica-1369	249	7	,	,	PUNCT
ecletica-1369	249	8	j.	j.	PROPN
ecletica-1369	249	9	a.	a.	PROPN
ecletica-1369	249	10	;	;	PUNCT
ecletica-1369	249	11	binkley	binkley	PROPN
ecletica-1369	249	12	,	,	PUNCT
ecletica-1369	249	13	j.	j.	PROPN
ecletica-1369	249	14	s.	s.	PROPN
ecletica-1369	249	15	self‐consistent	self‐consistent	VERB
ecletica-1369	249	16	molecular	molecular	ADJ
ecletica-1369	249	17	orbital	orbital	ADJ
ecletica-1369	249	18	methods	method	NOUN
ecletica-1369	249	19	25	25	NUM
ecletica-1369	249	20	.	.	PUNCT
ecletica-1369	250	1	supplementary	supplementary	ADJ
ecletica-1369	250	2	functions	function	NOUN
ecletica-1369	250	3	for	for	ADP
ecletica-1369	250	4	gaussian	gaussian	ADJ
ecletica-1369	250	5	basis	basis	NOUN
ecletica-1369	250	6	sets	set	NOUN
ecletica-1369	250	7	.	.	PUNCT
ecletica-1369	251	1	j.	j.	PROPN
ecletica-1369	251	2	chem	chem	PROPN
ecletica-1369	251	3	.	.	PUNCT
ecletica-1369	252	1	phys	phy	NOUN
ecletica-1369	252	2	.	.	PUNCT
ecletica-1369	252	3	1984	1984	NUM
ecletica-1369	252	4	,	,	PUNCT
ecletica-1369	252	5	80	80	NUM
ecletica-1369	252	6	(	(	PUNCT
ecletica-1369	252	7	7	7	NUM
ecletica-1369	252	8	)	)	PUNCT
ecletica-1369	252	9	,	,	PUNCT
ecletica-1369	252	10	3265	3265	NUM
ecletica-1369	252	11	.	.	PUNCT
ecletica-1369	253	1	https://doi.org/10.1063/1.447079	https://doi.org/10.1063/1.447079	PROPN
ecletica-1369	253	2	green	green	PROPN
ecletica-1369	253	3	,	,	PUNCT
ecletica-1369	253	4	m.	m.	NOUN
ecletica-1369	253	5	a.	a.	PROPN
ecletica-1369	253	6	;	;	PUNCT
ecletica-1369	253	7	emery	emery	PROPN
ecletica-1369	253	8	,	,	PUNCT
ecletica-1369	253	9	k.	k.	PROPN
ecletica-1369	253	10	;	;	PUNCT
ecletica-1369	253	11	king	king	PROPN
ecletica-1369	253	12	,	,	PUNCT
ecletica-1369	253	13	d.	d.	PROPN
ecletica-1369	253	14	l.	l.	PROPN
ecletica-1369	253	15	;	;	PUNCT
ecletica-1369	253	16	igari	igari	X
ecletica-1369	253	17	,	,	PUNCT
ecletica-1369	253	18	s.	s.	PROPN
ecletica-1369	253	19	;	;	PUNCT
ecletica-1369	253	20	warta	warta	PROPN
ecletica-1369	253	21	,	,	PUNCT
ecletica-1369	253	22	w.	w.	PROPN
ecletica-1369	253	23	short	short	ADJ
ecletica-1369	253	24	communication	communication	NOUN
ecletica-1369	253	25	:	:	PUNCT
ecletica-1369	253	26	solar	solar	ADJ
ecletica-1369	253	27	cell	cell	NOUN
ecletica-1369	253	28	efficiency	efficiency	NOUN
ecletica-1369	253	29	tables	table	NOUN
ecletica-1369	253	30	(	(	PUNCT
ecletica-1369	253	31	version	version	NOUN
ecletica-1369	253	32	25	25	NUM
ecletica-1369	253	33	)	)	PUNCT
ecletica-1369	253	34	.	.	PUNCT
ecletica-1369	254	1	prog	prog	PROPN
ecletica-1369	254	2	.	.	PUNCT
ecletica-1369	254	3	photovol	photovol	PROPN
ecletica-1369	254	4	.	.	PUNCT
ecletica-1369	255	1	2005	2005	NUM
ecletica-1369	255	2	,	,	PUNCT
ecletica-1369	255	3	13	13	NUM
ecletica-1369	255	4	(	(	PUNCT
ecletica-1369	255	5	1	1	NUM
ecletica-1369	255	6	)	)	PUNCT
ecletica-1369	255	7	,	,	PUNCT
ecletica-1369	255	8	49–54	49–54	NUM
ecletica-1369	255	9	.	.	PUNCT
ecletica-1369	256	1	https://doi.org/10.1002/pip.598	https://doi.org/10.1002/pip.598	ADJ
ecletica-1369	256	2	günes	güne	NOUN
ecletica-1369	256	3	,	,	PUNCT
ecletica-1369	256	4	s.	s.	PROPN
ecletica-1369	256	5	;	;	PUNCT
ecletica-1369	256	6	neugebauer	neugebauer	PROPN
ecletica-1369	256	7	,	,	PUNCT
ecletica-1369	256	8	h.	h.	PROPN
ecletica-1369	256	9	;	;	PUNCT
ecletica-1369	256	10	sariciftci	sariciftci	PROPN
ecletica-1369	256	11	,	,	PUNCT
ecletica-1369	256	12	n.	n.	PROPN
ecletica-1369	256	13	s.	s.	PROPN
ecletica-1369	256	14	conjugated	conjugate	VERB
ecletica-1369	256	15	polymer	polymer	NOUN
ecletica-1369	256	16	-	-	PUNCT
ecletica-1369	256	17	based	base	VERB
ecletica-1369	256	18	organic	organic	ADJ
ecletica-1369	256	19	solar	solar	ADJ
ecletica-1369	256	20	cells	cell	NOUN
ecletica-1369	256	21	.	.	PUNCT
ecletica-1369	257	1	chem	chem	PROPN
ecletica-1369	257	2	.	.	PUNCT
ecletica-1369	258	1	rev	rev	PROPN
ecletica-1369	258	2	.	.	PROPN
ecletica-1369	258	3	2007	2007	NUM
ecletica-1369	258	4	,	,	PUNCT
ecletica-1369	258	5	107	107	NUM
ecletica-1369	258	6	(	(	PUNCT
ecletica-1369	258	7	4	4	NUM
ecletica-1369	258	8	)	)	PUNCT
ecletica-1369	258	9	,	,	PUNCT
ecletica-1369	258	10	1324–1338	1324–1338	NUM
ecletica-1369	258	11	.	.	PUNCT
ecletica-1369	259	1	https://doi.org/10.1021/cr050149z	https://doi.org/10.1021/cr050149z	PROPN
ecletica-1369	259	2	huixia	huixia	NOUN
ecletica-1369	259	3	,	,	PUNCT
ecletica-1369	259	4	x.	x.	NOUN
ecletica-1369	259	5	;	;	PUNCT
ecletica-1369	259	6	fang	fang	X
ecletica-1369	259	7	,	,	PUNCT
ecletica-1369	259	8	w.	w.	PROPN
ecletica-1369	259	9	;	;	PUNCT
ecletica-1369	259	10	kexiang	kexiang	PROPN
ecletica-1369	259	11	,	,	PUNCT
ecletica-1369	259	12	w.	w.	PROPN
ecletica-1369	259	13	;	;	PUNCT
ecletica-1369	259	14	peng	peng	PROPN
ecletica-1369	259	15	,	,	PUNCT
ecletica-1369	259	16	s.	s.	PROPN
ecletica-1369	259	17	;	;	PUNCT
ecletica-1369	259	18	jie	jie	PROPN
ecletica-1369	259	19	,	,	PUNCT
ecletica-1369	259	20	l.	l.	PROPN
ecletica-1369	259	21	;	;	PUNCT
ecletica-1369	259	22	tingting	tingting	NOUN
ecletica-1369	259	23	,	,	PUNCT
ecletica-1369	259	24	y.	y.	PROPN
ecletica-1369	259	25	;	;	PUNCT
ecletica-1369	259	26	hua	hua	PROPN
ecletica-1369	259	27	,	,	PUNCT
ecletica-1369	259	28	w.	w.	PROPN
ecletica-1369	259	29	;	;	PUNCT
ecletica-1369	259	30	bingshe	bingshe	PROPN
ecletica-1369	259	31	,	,	PUNCT
ecletica-1369	259	32	x.	x.	NOUN
ecletica-1369	259	33	two	two	NUM
ecletica-1369	259	34	novel	novel	ADJ
ecletica-1369	259	35	bipolar	bipolar	ADJ
ecletica-1369	259	36	ir	ir	X
ecletica-1369	259	37	(	(	PUNCT
ecletica-1369	259	38	iii	iii	NOUN
ecletica-1369	259	39	)	)	PUNCT
ecletica-1369	259	40	complexes	complex	NOUN
ecletica-1369	259	41	based	base	VERB
ecletica-1369	259	42	on	on	ADP
ecletica-1369	259	43	9-(4-(pyridin-2	9-(4-(pyridin-2	NOUN
ecletica-1369	259	44	-	-	PUNCT
ecletica-1369	259	45	yl	yl	NOUN
ecletica-1369	259	46	)	)	PUNCT
ecletica-1369	259	47	phenyl)-9h	phenyl)-9h	NOUN
ecletica-1369	259	48	-	-	PUNCT
ecletica-1369	259	49	carbazole	carbazole	NOUN
ecletica-1369	259	50	and	and	CCONJ
ecletica-1369	259	51	nheterocyclic	nheterocyclic	ADJ
ecletica-1369	259	52	ligand	ligand	NOUN
ecletica-1369	259	53	.	.	PUNCT
ecletica-1369	260	1	dyes	dye	NOUN
ecletica-1369	260	2	pigm	pigm	PROPN
ecletica-1369	260	3	.	.	PUNCT
ecletica-1369	261	1	2017	2017	NUM
ecletica-1369	261	2	,	,	PUNCT
ecletica-1369	261	3	146	146	NUM
ecletica-1369	261	4	,	,	PUNCT
ecletica-1369	261	5	316–322	316–322	NUM
ecletica-1369	261	6	.	.	PUNCT
ecletica-1369	262	1	https://doi.org/10.1016/j.dyepig.2017.07.012	https://doi.org/10.1016/j.dyepig.2017.07.012	PROPN
ecletica-1369	262	2	jabha	jabha	NOUN
ecletica-1369	262	3	,	,	PUNCT
ecletica-1369	262	4	m.	m.	NOUN
ecletica-1369	262	5	;	;	PUNCT
ecletica-1369	262	6	abdelah	abdelah	PROPN
ecletica-1369	262	7	,	,	PUNCT
ecletica-1369	262	8	a.	a.	NOUN
ecletica-1369	262	9	study	study	NOUN
ecletica-1369	262	10	optoelectronic	optoelectronic	ADJ
ecletica-1369	262	11	and	and	CCONJ
ecletica-1369	262	12	geometric	geometric	ADJ
ecletica-1369	262	13	properties	property	NOUN
ecletica-1369	262	14	of	of	ADP
ecletica-1369	262	15	new	new	ADJ
ecletica-1369	262	16	compounds	compound	NOUN
ecletica-1369	262	17	based	base	VERB
ecletica-1369	262	18	on	on	ADP
ecletica-1369	262	19	carbazole	carbazole	ADJ
ecletica-1369	262	20	-	-	PUNCT
ecletica-1369	262	21	thiophene	thiophene	NOUN
ecletica-1369	262	22	bridged	bridge	VERB
ecletica-1369	262	23	for	for	ADP
ecletica-1369	262	24	solar	solar	ADJ
ecletica-1369	262	25	cells	cell	NOUN
ecletica-1369	262	26	.	.	PUNCT
ecletica-1369	263	1	orbital	orbital	ADJ
ecletica-1369	263	2	:	:	PUNCT
ecletica-1369	263	3	electron	electron	PROPN
ecletica-1369	263	4	.	.	PUNCT
ecletica-1369	264	1	j.	j.	PROPN
ecletica-1369	264	2	chem	chem	PROPN
ecletica-1369	264	3	.	.	PUNCT
ecletica-1369	265	1	2018	2018	NUM
ecletica-1369	265	2	,	,	PUNCT
ecletica-1369	265	3	10	10	NUM
ecletica-1369	265	4	(	(	PUNCT
ecletica-1369	265	5	7	7	NUM
ecletica-1369	265	6	)	)	PUNCT
ecletica-1369	265	7	,	,	PUNCT
ecletica-1369	265	8	552–560	552–560	NUM
ecletica-1369	265	9	.	.	PUNCT
ecletica-1369	266	1	https://doi.org/10.17807/orbital.v10i7.1322	https://doi.org/10.17807/orbital.v10i7.1322	PROPN
ecletica-1369	266	2	jabha	jabha	PROPN
ecletica-1369	266	3	,	,	PUNCT
ecletica-1369	266	4	m.	m.	NOUN
ecletica-1369	266	5	;	;	PUNCT
ecletica-1369	266	6	el	el	PROPN
ecletica-1369	266	7	alaoui	alaoui	PROPN
ecletica-1369	266	8	,	,	PUNCT
ecletica-1369	266	9	a.	a.	NOUN
ecletica-1369	266	10	;	;	PUNCT
ecletica-1369	266	11	jarid	jarid	PROPN
ecletica-1369	266	12	,	,	PUNCT
ecletica-1369	266	13	a.	a.	NOUN
ecletica-1369	266	14	;	;	PUNCT
ecletica-1369	266	15	mabrouk	mabrouk	PROPN
ecletica-1369	266	16	,	,	PUNCT
ecletica-1369	266	17	e.	e.	PROPN
ecletica-1369	266	18	h.	h.	PROPN
ecletica-1369	266	19	the	the	DET
ecletica-1369	266	20	effect	effect	NOUN
ecletica-1369	266	21	of	of	ADP
ecletica-1369	266	22	substitution	substitution	NOUN
ecletica-1369	266	23	and	and	CCONJ
ecletica-1369	266	24	polymerization	polymerization	NOUN
ecletica-1369	266	25	of	of	ADP
ecletica-1369	266	26	2	2	NUM
ecletica-1369	266	27	,	,	PUNCT
ecletica-1369	266	28	7	7	NUM
ecletica-1369	266	29	-	-	PUNCT
ecletica-1369	266	30	divinylcarbazolebenzo	divinylcarbazolebenzo	NOUN
ecletica-1369	266	31	-	-	PUNCT
ecletica-1369	266	32	bis	bis	NOUN
ecletica-1369	266	33	-	-	NOUN
ecletica-1369	266	34	thiadiazole	thiadiazole	NOUN
ecletica-1369	266	35	on	on	ADP
ecletica-1369	266	36	optoelectronic	optoelectronic	ADJ
ecletica-1369	266	37	properties	property	NOUN
ecletica-1369	266	38	:	:	PUNCT
ecletica-1369	266	39	a	a	DET
ecletica-1369	266	40	dft	dft	PROPN
ecletica-1369	266	41	study	study	NOUN
ecletica-1369	266	42	.	.	PUNCT
ecletica-1369	267	1	orbital	orbital	ADJ
ecletica-1369	267	2	:	:	PUNCT
ecletica-1369	267	3	electron	electron	PROPN
ecletica-1369	267	4	.	.	PUNCT
ecletica-1369	268	1	j.	j.	PROPN
ecletica-1369	268	2	chem	chem	PROPN
ecletica-1369	268	3	.	.	PUNCT
ecletica-1369	269	1	2021	2021	NUM
ecletica-1369	269	2	,	,	PUNCT
ecletica-1369	269	3	13	13	NUM
ecletica-1369	269	4	(	(	PUNCT
ecletica-1369	269	5	4	4	NUM
ecletica-1369	269	6	)	)	PUNCT
ecletica-1369	269	7	,	,	PUNCT
ecletica-1369	269	8	291–300	291–300	NUM
ecletica-1369	269	9	.	.	PUNCT
ecletica-1369	270	1	https://doi.org/10.17807/orbital.v13i4.1580	https://doi.org/10.17807/orbital.v13i4.1580	ADP
ecletica-1369	270	2	jabha	jabha	PROPN
ecletica-1369	270	3	,	,	PUNCT
ecletica-1369	270	4	m.	m.	NOUN
ecletica-1369	270	5	;	;	PUNCT
ecletica-1369	270	6	el	el	PROPN
ecletica-1369	270	7	alaoui	alaoui	PROPN
ecletica-1369	270	8	,	,	PUNCT
ecletica-1369	270	9	a.	a.	NOUN
ecletica-1369	270	10	;	;	PUNCT
ecletica-1369	270	11	jarid	jarid	PROPN
ecletica-1369	270	12	,	,	PUNCT
ecletica-1369	270	13	a.	a.	NOUN
ecletica-1369	270	14	;	;	PUNCT
ecletica-1369	270	15	mabrouk	mabrouk	PROPN
ecletica-1369	270	16	,	,	PUNCT
ecletica-1369	270	17	e.	e.	PROPN
ecletica-1369	270	18	h.	h.	PROPN
ecletica-1369	270	19	theoretically	theoretically	ADV
ecletica-1369	270	20	studying	study	VERB
ecletica-1369	270	21	the	the	DET
ecletica-1369	270	22	optoelectronic	optoelectronic	ADJ
ecletica-1369	270	23	properties	property	NOUN
ecletica-1369	270	24	of	of	ADP
ecletica-1369	270	25	oligomers	oligomer	NOUN
ecletica-1369	270	26	based	base	VERB
ecletica-1369	270	27	on	on	ADP
ecletica-1369	270	28	2.7	2.7	NUM
ecletica-1369	270	29	-	-	PUNCT
ecletica-1369	270	30	divinyl	divinyl	NOUN
ecletica-1369	270	31	-	-	PUNCT
ecletica-1369	270	32	cabazole	cabazole	NOUN
ecletica-1369	270	33	.	.	PUNCT
ecletica-1369	271	1	eclet	eclet	PROPN
ecletica-1369	271	2	.	.	PUNCT
ecletica-1369	272	1	quim	quim	PROPN
ecletica-1369	272	2	.	.	PUNCT
ecletica-1369	273	1	j.	j.	PROPN
ecletica-1369	273	2	2022	2022	PROPN
ecletica-1369	273	3	,	,	PUNCT
ecletica-1369	273	4	47	47	NUM
ecletica-1369	273	5	(	(	PUNCT
ecletica-1369	273	6	1	1	NUM
ecletica-1369	273	7	)	)	PUNCT
ecletica-1369	273	8	,	,	PUNCT
ecletica-1369	273	9	40–54	40–54	NUM
ecletica-1369	273	10	.	.	PUNCT
ecletica-1369	274	1	https://doi.org/10.26850/16784618eqj.v47.1.2022.p40-54	https://doi.org/10.26850/16784618eqj.v47.1.2022.p40-54	PROPN
ecletica-1369	274	2	khoudir	khoudir	NOUN
ecletica-1369	274	3	,	,	PUNCT
ecletica-1369	274	4	a.	a.	NOUN
ecletica-1369	274	5	;	;	PUNCT
ecletica-1369	274	6	maruani	maruani	PROPN
ecletica-1369	274	7	,	,	PUNCT
ecletica-1369	274	8	j.	j.	PROPN
ecletica-1369	274	9	;	;	PUNCT
ecletica-1369	274	10	tronc	tronc	PROPN
ecletica-1369	274	11	,	,	PUNCT
ecletica-1369	274	12	m.	m.	NOUN
ecletica-1369	274	13	scf	scf	PROPN
ecletica-1369	274	14	,	,	PUNCT
ecletica-1369	274	15	ci	ci	PROPN
ecletica-1369	274	16	and	and	CCONJ
ecletica-1369	274	17	dft	dft	PROPN
ecletica-1369	274	18	charge	charge	NOUN
ecletica-1369	274	19	transfers	transfer	NOUN
ecletica-1369	274	20	and	and	CCONJ
ecletica-1369	274	21	xps	xps	ADJ
ecletica-1369	274	22	chemical	chemical	ADJ
ecletica-1369	274	23	shifts	shift	NOUN
ecletica-1369	274	24	in	in	ADP
ecletica-1369	274	25	fluorinated	fluorinate	VERB
ecletica-1369	274	26	compounds	compound	NOUN
ecletica-1369	274	27	.	.	PUNCT
ecletica-1369	275	1	in	in	ADP
ecletica-1369	275	2	quantum	quantum	ADJ
ecletica-1369	275	3	systems	system	NOUN
ecletica-1369	275	4	in	in	ADP
ecletica-1369	275	5	chemistry	chemistry	NOUN
ecletica-1369	275	6	and	and	CCONJ
ecletica-1369	275	7	physics	physic	NOUN
ecletica-1369	275	8	;	;	PUNCT
ecletica-1369	275	9	hernández	hernández	PROPN
ecletica-1369	275	10	-	-	PUNCT
ecletica-1369	275	11	laguna	laguna	PROPN
ecletica-1369	275	12	,	,	PUNCT
ecletica-1369	275	13	a.	a.	PROPN
ecletica-1369	275	14	,	,	PUNCT
ecletica-1369	275	15	maruani	maruani	PROPN
ecletica-1369	275	16	,	,	PUNCT
ecletica-1369	275	17	j.	j.	PROPN
ecletica-1369	275	18	,	,	PUNCT
ecletica-1369	275	19	mcweeny	mcweeny	PROPN
ecletica-1369	275	20	,	,	PUNCT
ecletica-1369	275	21	r.	r.	PROPN
ecletica-1369	275	22	,	,	PUNCT
ecletica-1369	275	23	wilson	wilson	PROPN
ecletica-1369	275	24	,	,	PUNCT
ecletica-1369	275	25	s.	s.	PROPN
ecletica-1369	275	26	,	,	PUNCT
ecletica-1369	275	27	eds	eds	PROPN
ecletica-1369	275	28	.	.	PROPN
ecletica-1369	275	29	,	,	PUNCT
ecletica-1369	275	30	vol	vol	NOUN
ecletica-1369	275	31	.	.	PROPN
ecletica-1369	275	32	2	2	NUM
ecletica-1369	275	33	;	;	PUNCT
ecletica-1369	275	34	springer	springer	NOUN
ecletica-1369	275	35	,	,	PUNCT
ecletica-1369	275	36	2000	2000	NUM
ecletica-1369	275	37	;	;	PUNCT
ecletica-1369	275	38	pp	pp	ADP
ecletica-1369	275	39	57–89	57–89	NUM
ecletica-1369	275	40	.	.	PUNCT
ecletica-1369	276	1	https://doi.org/10.1007/0-306-48145-6_5	https://doi.org/10.1007/0-306-48145-6_5	PROPN
ecletica-1369	276	2	koh	koh	PROPN
ecletica-1369	276	3	,	,	PUNCT
ecletica-1369	276	4	s.	s.	PROPN
ecletica-1369	276	5	e.	e.	PROPN
ecletica-1369	276	6	;	;	PUNCT
ecletica-1369	276	7	risko	risko	ADV
ecletica-1369	276	8	,	,	PUNCT
ecletica-1369	276	9	c.	c.	PROPN
ecletica-1369	276	10	;	;	PUNCT
ecletica-1369	276	11	silva	silva	NOUN
ecletica-1369	276	12	filho	filho	PROPN
ecletica-1369	276	13	,	,	PUNCT
ecletica-1369	276	14	d.	d.	PROPN
ecletica-1369	276	15	a.	a.	PROPN
ecletica-1369	276	16	;	;	PUNCT
ecletica-1369	276	17	kwon	kwon	PROPN
ecletica-1369	276	18	,	,	PUNCT
ecletica-1369	276	19	o.	o.	INTJ
ecletica-1369	276	20	;	;	PUNCT
ecletica-1369	276	21	facchetti	facchetti	PROPN
ecletica-1369	276	22	,	,	PUNCT
ecletica-1369	276	23	a.	a.	NOUN
ecletica-1369	276	24	;	;	PUNCT
ecletica-1369	276	25	brédas	bréda	NOUN
ecletica-1369	276	26	,	,	PUNCT
ecletica-1369	276	27	j.-l	j.-l	PROPN
ecletica-1369	276	28	.	.	PUNCT
ecletica-1369	276	29	;	;	PUNCT
ecletica-1369	276	30	marks	mark	NOUN
ecletica-1369	276	31	,	,	PUNCT
ecletica-1369	276	32	t.	t.	PROPN
ecletica-1369	276	33	j.	j.	PROPN
ecletica-1369	276	34	;	;	PUNCT
ecletica-1369	276	35	ratner	ratner	PROPN
ecletica-1369	276	36	,	,	PUNCT
ecletica-1369	276	37	m.	m.	NOUN
ecletica-1369	276	38	a.	a.	NOUN
ecletica-1369	276	39	modeling	modeling	NOUN
ecletica-1369	276	40	electron	electron	NOUN
ecletica-1369	276	41	and	and	CCONJ
ecletica-1369	276	42	hole	hole	NOUN
ecletica-1369	276	43	transport	transport	NOUN
ecletica-1369	276	44	in	in	ADP
ecletica-1369	276	45	fluoroarene‐oligothiopene	fluoroarene‐oligothiopene	ADJ
ecletica-1369	276	46	semiconductors	semiconductor	NOUN
ecletica-1369	276	47	:	:	PUNCT
ecletica-1369	276	48	investigation	investigation	NOUN
ecletica-1369	276	49	of	of	ADP
ecletica-1369	276	50	geometric	geometric	ADJ
ecletica-1369	276	51	and	and	CCONJ
ecletica-1369	276	52	electronic	electronic	ADJ
ecletica-1369	276	53	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	NOUN
ecletica-1369	276	54	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	VERB
ecletica-1369	276	55	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	X
ecletica-1369	276	56	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	NUM
ecletica-1369	276	57	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	NUM
ecletica-1369	276	58	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	NUM
ecletica-1369	276	59	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	NUM
ecletica-1369	276	60	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	https://library-rchives.canada.ca/eng/services/services-libraries/theses/pages/item.aspx?idnumber=648383653	NUM
ecletica-1369	276	61	https://doi.org/10.3406/barb.2002.28296	https://doi.org/10.3406/barb.2002.28296	PROPN
ecletica-1369	276	62	https://doi.org/10.3406/barb.2002.28296	https://doi.org/10.3406/barb.2002.28296	PROPN
ecletica-1369	276	63	https://doi.org/10.3406/barb.2002.28296	https://doi.org/10.3406/barb.2002.28296	PROPN
ecletica-1369	276	64	https://doi.org/10.3406/barb.2002.28296	https://doi.org/10.3406/barb.2002.28296	PROPN
ecletica-1369	276	65	https://doi.org/10.3406/barb.2002.28296	https://doi.org/10.3406/barb.2002.28296	PROPN
ecletica-1369	276	66	https://doi.org/10.1016/0009-2614(95)00299-j	https://doi.org/10.1016/0009-2614(95)00299-j	VERB
ecletica-1369	276	67	https://doi.org/10.1016/0009-2614(95)00299-j	https://doi.org/10.1016/0009-2614(95)00299-j	ADV
ecletica-1369	276	68	https://doi.org/10.1016/0009-2614(95)00299-j	https://doi.org/10.1016/0009-2614(95)00299-j	ADJ
ecletica-1369	276	69	https://doi.org/10.1016/0009-2614(95)00299-j	https://doi.org/10.1016/0009-2614(95)00299-j	ADJ
ecletica-1369	276	70	https://doi.org/10.2533/chimia.1991.352	https://doi.org/10.2533/chimia.1991.352	NOUN
ecletica-1369	276	71	https://doi.org/10.2533/chimia.1991.352	https://doi.org/10.2533/chimia.1991.352	ADJ
ecletica-1369	276	72	https://doi.org/10.2533/chimia.1991.352	https://doi.org/10.2533/chimia.1991.352	ADJ
ecletica-1369	276	73	https://doi.org/10.2533/chimia.1991.352	https://doi.org/10.2533/chimia.1991.352	ADJ
ecletica-1369	276	74	https://doi.org/10.1038/nmat4797	https://doi.org/10.1038/nmat4797	NOUN
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ecletica-1369	286	17	https://doi.org/10.26850/1678-4618eqj.v47.1.2022.p40-54	https://doi.org/10.26850/1678-4618eqj.v47.1.2022.p40-54	NUM
ecletica-1369	286	18	https://doi.org/10.26850/1678-4618eqj.v47.1.2022.p40-54	https://doi.org/10.26850/1678-4618eqj.v47.1.2022.p40-54	NUM
ecletica-1369	286	19	https://doi.org/10.26850/1678-4618eqj.v47.1.2022.p40-54	https://doi.org/10.26850/1678-4618eqj.v47.1.2022.p40-54	ADJ
ecletica-1369	286	20	https://doi.org/10.26850/1678-4618eqj.v47.1.2022.p40-54	https://doi.org/10.26850/1678-4618eqj.v47.1.2022.p40-54	PROPN
ecletica-1369	286	21	https://doi.org/10.1007/0-306-48145-6_5	https://doi.org/10.1007/0-306-48145-6_5	PROPN
ecletica-1369	286	22	https://doi.org/10.1007/0-306-48145-6_5	https://doi.org/10.1007/0-306-48145-6_5	PROPN
ecletica-1369	286	23	https://doi.org/10.1007/0-306-48145-6_5	https://doi.org/10.1007/0-306-48145-6_5	PROPN
ecletica-1369	286	24	https://doi.org/10.1007/0-306-48145-6_5	https://doi.org/10.1007/0-306-48145-6_5	PROPN
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ecletica-1369	287	14	-	-	SYM
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ecletica-1369	287	19	-	-	SYM
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ecletica-1369	287	21	-	-	PUNCT
ecletica-1369	287	22	68	68	NUM
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ecletica-1369	290	8	332	332	NUM
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ecletica-1369	290	10	340	340	NUM
ecletica-1369	290	11	.	.	PUNCT
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ecletica-1369	291	13	;	;	PUNCT
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ecletica-1369	291	18	;	;	PUNCT
ecletica-1369	291	19	leclerc	leclerc	PROPN
ecletica-1369	291	20	,	,	PUNCT
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ecletica-1369	294	1	mater	mater	PROPN
ecletica-1369	294	2	.	.	PUNCT
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ecletica-1369	295	2	,	,	PUNCT
ecletica-1369	295	3	16	16	NUM
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ecletica-1369	295	7	,	,	PUNCT
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ecletica-1369	295	9	.	.	PUNCT
ecletica-1369	295	10	https://doi.org/10.1002/adfm.200600171	https://doi.org/10.1002/adfm.200600171	X
ecletica-1369	296	1	liu	liu	PROPN
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ecletica-1369	296	9	;	;	PUNCT
ecletica-1369	296	10	forrest	forrest	PROPN
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ecletica-1369	297	1	trends	trend	NOUN
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ecletica-1369	298	2	,	,	PUNCT
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ecletica-1369	298	7	,	,	PUNCT
ecletica-1369	298	8	815–829	815–829	NUM
ecletica-1369	298	9	.	.	PUNCT
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ecletica-1369	302	8	.	.	PUNCT
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ecletica-1369	303	28	carrasco	carrasco	PROPN
ecletica-1369	303	29	-	-	PUNCT
ecletica-1369	303	30	orozco	orozco	PROPN
ecletica-1369	303	31	,	,	PUNCT
ecletica-1369	303	32	m.	m.	NOUN
ecletica-1369	303	33	;	;	PUNCT
ecletica-1369	303	34	thelakkat	thelakkat	PROPN
ecletica-1369	303	35	,	,	PUNCT
ecletica-1369	303	36	m.	m.	NOUN
ecletica-1369	303	37	influence	influence	NOUN
ecletica-1369	303	38	of	of	ADP
ecletica-1369	303	39	charge	charge	NOUN
ecletica-1369	303	40	carrier	carrier	NOUN
ecletica-1369	303	41	mobility	mobility	NOUN
ecletica-1369	303	42	and	and	CCONJ
ecletica-1369	303	43	morphology	morphology	NOUN
ecletica-1369	303	44	on	on	ADP
ecletica-1369	303	45	solar	solar	ADJ
ecletica-1369	303	46	cell	cell	NOUN
ecletica-1369	303	47	parameters	parameter	NOUN
ecletica-1369	303	48	in	in	ADP
ecletica-1369	303	49	devices	device	NOUN
ecletica-1369	303	50	of	of	ADP
ecletica-1369	303	51	mono	mono	PROPN
ecletica-1369	303	52	-	-	PUNCT
ecletica-1369	303	53	and	and	CCONJ
ecletica-1369	303	54	bis	bis	ADJ
ecletica-1369	303	55	-	-	PUNCT
ecletica-1369	303	56	fullerene	fullerene	NOUN
ecletica-1369	303	57	adducts	adduct	NOUN
ecletica-1369	303	58	.	.	PUNCT
ecletica-1369	304	1	j.	j.	PROPN
ecletica-1369	304	2	nanotechnol	nanotechnol	PROPN
ecletica-1369	304	3	.	.	PUNCT
ecletica-1369	305	1	2013	2013	NUM
ecletica-1369	305	2	,	,	PUNCT
ecletica-1369	305	3	24	24	NUM
ecletica-1369	305	4	(	(	PUNCT
ecletica-1369	305	5	48	48	NUM
ecletica-1369	305	6	)	)	PUNCT
ecletica-1369	305	7	,	,	PUNCT
ecletica-1369	305	8	484001	484001	NUM
ecletica-1369	305	9	.	.	PUNCT
ecletica-1369	306	1	https://doi.org/10.1088/0957-4484/24/48/484001	https://doi.org/10.1088/0957-4484/24/48/484001	PROPN
ecletica-1369	306	2	ochterski	ochterski	PROPN
ecletica-1369	306	3	,	,	PUNCT
ecletica-1369	306	4	j.	j.	PROPN
ecletica-1369	306	5	w.	w.	PROPN
ecletica-1369	306	6	;	;	PUNCT
ecletica-1369	306	7	petersson	petersson	PROPN
ecletica-1369	306	8	,	,	PUNCT
ecletica-1369	306	9	g.	g.	PROPN
ecletica-1369	306	10	a.	a.	PROPN
ecletica-1369	306	11	;	;	PUNCT
ecletica-1369	306	12	montgomery	montgomery	PROPN
ecletica-1369	306	13	junior	junior	PROPN
ecletica-1369	306	14	,	,	PUNCT
ecletica-1369	306	15	j.	j.	PROPN
ecletica-1369	306	16	a.	a.	PROPN
ecletica-1369	307	1	a	a	DET
ecletica-1369	307	2	complete	complete	ADJ
ecletica-1369	307	3	basis	basis	NOUN
ecletica-1369	307	4	set	set	NOUN
ecletica-1369	307	5	model	model	NOUN
ecletica-1369	307	6	chemistry	chemistry	NOUN
ecletica-1369	307	7	.	.	PUNCT
ecletica-1369	308	1	v.	v.	ADP
ecletica-1369	308	2	extensions	extension	NOUN
ecletica-1369	308	3	to	to	ADP
ecletica-1369	308	4	six	six	NUM
ecletica-1369	308	5	or	or	CCONJ
ecletica-1369	308	6	more	more	ADV
ecletica-1369	308	7	heavy	heavy	ADJ
ecletica-1369	308	8	atoms	atom	NOUN
ecletica-1369	308	9	.	.	PUNCT
ecletica-1369	309	1	j.	j.	PROPN
ecletica-1369	309	2	chem	chem	PROPN
ecletica-1369	309	3	.	.	PUNCT
ecletica-1369	310	1	phys	phy	NOUN
ecletica-1369	310	2	.	.	PUNCT
ecletica-1369	311	1	1996	1996	NUM
ecletica-1369	311	2	,	,	PUNCT
ecletica-1369	311	3	104	104	NUM
ecletica-1369	311	4	(	(	PUNCT
ecletica-1369	311	5	7	7	NUM
ecletica-1369	311	6	)	)	PUNCT
ecletica-1369	311	7	,	,	PUNCT
ecletica-1369	311	8	2598	2598	NUM
ecletica-1369	311	9	.	.	PUNCT
ecletica-1369	312	1	https://doi.org/10.1063/1.470985	https://doi.org/10.1063/1.470985	PROPN
ecletica-1369	312	2	oukachmih	oukachmih	PROPN
ecletica-1369	312	3	,	,	PUNCT
ecletica-1369	312	4	m.	m.	NOUN
ecletica-1369	312	5	université	université	PROPN
ecletica-1369	312	6	toulouse	toulouse	PROPN
ecletica-1369	312	7	-	-	PUNCT
ecletica-1369	312	8	paul	paul	PROPN
ecletica-1369	312	9	sabatier	sabatier	PROPN
ecletica-1369	312	10	,	,	PUNCT
ecletica-1369	312	11	france	france	PROPN
ecletica-1369	312	12	.	.	PUNCT
ecletica-1369	312	13	2003	2003	NUM
ecletica-1369	312	14	.	.	PUNCT
ecletica-1369	313	1	(	(	PUNCT
ecletica-1369	313	2	doctoral	doctoral	ADJ
ecletica-1369	313	3	theses	thesis	NOUN
ecletica-1369	313	4	)	)	PUNCT
ecletica-1369	313	5	.	.	PUNCT
ecletica-1369	314	1	petersson	petersson	PROPN
ecletica-1369	314	2	,	,	PUNCT
ecletica-1369	314	3	g.	g.	PROPN
ecletica-1369	314	4	a.	a.	PROPN
ecletica-1369	314	5	;	;	PUNCT
ecletica-1369	314	6	al‐laham	al‐laham	PROPN
ecletica-1369	314	7	,	,	PUNCT
ecletica-1369	314	8	m.	m.	NOUN
ecletica-1369	314	9	a.	a.	NOUN
ecletica-1369	314	10	a	a	DET
ecletica-1369	314	11	complete	complete	ADJ
ecletica-1369	314	12	basis	basis	NOUN
ecletica-1369	314	13	set	set	NOUN
ecletica-1369	314	14	model	model	NOUN
ecletica-1369	314	15	chemistry	chemistry	PROPN
ecletica-1369	314	16	.	.	PUNCT
ecletica-1369	315	1	ii	ii	PROPN
ecletica-1369	315	2	.	.	PUNCT
ecletica-1369	316	1	open‐shell	open‐shell	PROPN
ecletica-1369	316	2	systems	system	NOUN
ecletica-1369	316	3	and	and	CCONJ
ecletica-1369	316	4	the	the	DET
ecletica-1369	316	5	total	total	ADJ
ecletica-1369	316	6	energies	energy	NOUN
ecletica-1369	316	7	of	of	ADP
ecletica-1369	316	8	the	the	DET
ecletica-1369	316	9	first‐row	first‐row	NOUN
ecletica-1369	316	10	atoms	atom	NOUN
ecletica-1369	316	11	.	.	PUNCT
ecletica-1369	317	1	j.	j.	PROPN
ecletica-1369	317	2	chem	chem	PROPN
ecletica-1369	317	3	.	.	PUNCT
ecletica-1369	318	1	phys	phy	NOUN
ecletica-1369	318	2	.	.	PUNCT
ecletica-1369	319	1	1991	1991	NUM
ecletica-1369	319	2	,	,	PUNCT
ecletica-1369	319	3	94	94	NUM
ecletica-1369	319	4	(	(	PUNCT
ecletica-1369	319	5	9	9	NUM
ecletica-1369	319	6	)	)	PUNCT
ecletica-1369	319	7	,	,	PUNCT
ecletica-1369	319	8	6081	6081	NUM
ecletica-1369	319	9	https://doi.org/10.1063/1.460447	https://doi.org/10.1063/1.460447	NOUN
ecletica-1369	319	10	provencher	provencher	PROPN
ecletica-1369	319	11	,	,	PUNCT
ecletica-1369	319	12	f.	f.	PROPN
ecletica-1369	319	13	dynamique	dynamique	PROPN
ecletica-1369	319	14	de	de	PROPN
ecletica-1369	319	15	séparation	séparation	PROPN
ecletica-1369	319	16	de	de	PROPN
ecletica-1369	319	17	charges	charge	NOUN
ecletica-1369	319	18	à	à	X
ecletica-1369	319	19	l’hétérojonction	l’hétérojonction	NOUN
ecletica-1369	319	20	de	de	PROPN
ecletica-1369	319	21	semi	semi	ADJ
ecletica-1369	319	22	-	-	ADJ
ecletica-1369	319	23	conducteurs	conducteurs	ADJ
ecletica-1369	319	24	organiques	organique	NOUN
ecletica-1369	319	25	.	.	PUNCT
ecletica-1369	320	1	ph.d	ph.d	PROPN
ecletica-1369	320	2	.	.	PUNCT
ecletica-1369	321	1	thesis	thesis	NOUN
ecletica-1369	321	2	,	,	PUNCT
ecletica-1369	321	3	university	university	PROPN
ecletica-1369	321	4	of	of	ADP
ecletica-1369	321	5	montreal	montreal	PROPN
ecletica-1369	321	6	,	,	PUNCT
ecletica-1369	321	7	2014	2014	NUM
ecletica-1369	321	8	.	.	PUNCT
ecletica-1369	322	1	http://hdl.handle.net/1866/10654	http://hdl.handle.net/1866/10654	PROPN
ecletica-1369	322	2	(	(	PUNCT
ecletica-1369	322	3	accessed	access	VERB
ecletica-1369	322	4	2022	2022	NUM
ecletica-1369	322	5	-	-	SYM
ecletica-1369	322	6	02	02	NUM
ecletica-1369	322	7	-	-	PUNCT
ecletica-1369	322	8	24	24	NUM
ecletica-1369	322	9	)	)	PUNCT
ecletica-1369	322	10	rassolov	rassolov	NOUN
ecletica-1369	322	11	,	,	PUNCT
ecletica-1369	322	12	v.	v.	PROPN
ecletica-1369	322	13	a.	a.	NOUN
ecletica-1369	322	14	;	;	PUNCT
ecletica-1369	322	15	ratner	ratner	PROPN
ecletica-1369	322	16	,	,	PUNCT
ecletica-1369	322	17	m.	m.	NOUN
ecletica-1369	322	18	a.	a.	NOUN
ecletica-1369	322	19	;	;	PUNCT
ecletica-1369	322	20	pople	pople	PROPN
ecletica-1369	322	21	,	,	PUNCT
ecletica-1369	322	22	j.	j.	PROPN
ecletica-1369	322	23	a.	a.	PROPN
ecletica-1369	322	24	;	;	PUNCT
ecletica-1369	322	25	redfern	redfern	PROPN
ecletica-1369	322	26	,	,	PUNCT
ecletica-1369	322	27	p.	p.	PROPN
ecletica-1369	322	28	c.	c.	PROPN
ecletica-1369	322	29	;	;	PUNCT
ecletica-1369	322	30	curtiss	curtiss	PROPN
ecletica-1369	322	31	,	,	PUNCT
ecletica-1369	323	1	l.	l.	PROPN
ecletica-1369	323	2	a.	a.	PROPN
ecletica-1369	323	3	6‐31	6‐31	PROPN
ecletica-1369	323	4	g	g	NOUN
ecletica-1369	323	5	*	*	PUNCT
ecletica-1369	323	6	basis	basis	NOUN
ecletica-1369	323	7	set	set	NOUN
ecletica-1369	323	8	for	for	ADP
ecletica-1369	323	9	third‐row	third‐row	NOUN
ecletica-1369	323	10	atoms	atom	NOUN
ecletica-1369	323	11	.	.	PUNCT
ecletica-1369	324	1	j.	j.	PROPN
ecletica-1369	324	2	comput	comput	PROPN
ecletica-1369	324	3	.	.	PUNCT
ecletica-1369	325	1	chem	chem	PROPN
ecletica-1369	325	2	.	.	PUNCT
ecletica-1369	326	1	2001	2001	NUM
ecletica-1369	326	2	,	,	PUNCT
ecletica-1369	326	3	22	22	NUM
ecletica-1369	326	4	(	(	PUNCT
ecletica-1369	326	5	9	9	NUM
ecletica-1369	326	6	)	)	PUNCT
ecletica-1369	326	7	,	,	PUNCT
ecletica-1369	326	8	976–984	976–984	NUM
ecletica-1369	326	9	.	.	PUNCT
ecletica-1369	327	1	https://doi.org/10.1002/jcc.1058	https://doi.org/10.1002/jcc.1058	ADJ
ecletica-1369	327	2	rodríguez	rodríguez	PROPN
ecletica-1369	327	3	-	-	PUNCT
ecletica-1369	327	4	monge	monge	PROPN
ecletica-1369	327	5	,	,	PUNCT
ecletica-1369	327	6	l.	l.	PROPN
ecletica-1369	327	7	;	;	PUNCT
ecletica-1369	327	8	larsson	larsson	PROPN
ecletica-1369	327	9	,	,	PUNCT
ecletica-1369	327	10	s.	s.	PROPN
ecletica-1369	327	11	conductivity	conductivity	VERB
ecletica-1369	327	12	in	in	ADP
ecletica-1369	327	13	polyacetylene	polyacetylene	NOUN
ecletica-1369	327	14	.	.	PUNCT
ecletica-1369	328	1	i.	i.	PROPN
ecletica-1369	328	2	ab	ab	PROPN
ecletica-1369	328	3	initio	initio	PROPN
ecletica-1369	328	4	calculation	calculation	NOUN
ecletica-1369	328	5	of	of	ADP
ecletica-1369	328	6	charge	charge	NOUN
ecletica-1369	328	7	localization	localization	NOUN
ecletica-1369	328	8	,	,	PUNCT
ecletica-1369	328	9	bond	bond	NOUN
ecletica-1369	328	10	distances	distance	NOUN
ecletica-1369	328	11	,	,	PUNCT
ecletica-1369	328	12	and	and	CCONJ
ecletica-1369	328	13	reorganization	reorganization	NOUN
ecletica-1369	328	14	energy	energy	NOUN
ecletica-1369	328	15	in	in	ADP
ecletica-1369	328	16	model	model	NOUN
ecletica-1369	328	17	molecules	molecule	NOUN
ecletica-1369	328	18	.	.	PUNCT
ecletica-1369	329	1	j.	j.	PROPN
ecletica-1369	329	2	chem	chem	PROPN
ecletica-1369	329	3	.	.	PUNCT
ecletica-1369	330	1	phys	phy	NOUN
ecletica-1369	330	2	.	.	PUNCT
ecletica-1369	331	1	1995	1995	NUM
ecletica-1369	331	2	,	,	PUNCT
ecletica-1369	331	3	102	102	NUM
ecletica-1369	331	4	(	(	PUNCT
ecletica-1369	331	5	18	18	NUM
ecletica-1369	331	6	)	)	PUNCT
ecletica-1369	331	7	,	,	PUNCT
ecletica-1369	331	8	7106	7106	NUM
ecletica-1369	331	9	.	.	PUNCT
ecletica-1369	332	1	https://doi.org/10.1063/1.469104	https://doi.org/10.1063/1.469104	PROPN
ecletica-1369	332	2	schwenn	schwenn	PROPN
ecletica-1369	332	3	,	,	PUNCT
ecletica-1369	332	4	p.	p.	PROPN
ecletica-1369	332	5	e.	e.	PROPN
ecletica-1369	332	6	;	;	PUNCT
ecletica-1369	332	7	burn	burn	VERB
ecletica-1369	332	8	,	,	PUNCT
ecletica-1369	332	9	p.	p.	PROPN
ecletica-1369	332	10	l.	l.	PROPN
ecletica-1369	332	11	;	;	PUNCT
ecletica-1369	333	1	powell	powell	PROPN
ecletica-1369	333	2	,	,	PUNCT
ecletica-1369	333	3	b.	b.	PROPN
ecletica-1369	333	4	j.	j.	PROPN
ecletica-1369	333	5	calculation	calculation	PROPN
ecletica-1369	333	6	of	of	ADP
ecletica-1369	333	7	solid	solid	ADJ
ecletica-1369	333	8	state	state	NOUN
ecletica-1369	333	9	molecular	molecular	ADJ
ecletica-1369	333	10	ionisation	ionisation	NOUN
ecletica-1369	333	11	energies	energy	NOUN
ecletica-1369	333	12	and	and	CCONJ
ecletica-1369	333	13	electron	electron	NOUN
ecletica-1369	333	14	affinities	affinity	NOUN
ecletica-1369	333	15	for	for	ADP
ecletica-1369	333	16	organic	organic	ADJ
ecletica-1369	333	17	semiconductors	semiconductor	NOUN
ecletica-1369	333	18	.	.	PUNCT
ecletica-1369	334	1	org	org	NOUN
ecletica-1369	334	2	.	.	PUNCT
ecletica-1369	334	3	electron	electron	PROPN
ecletica-1369	334	4	.	.	PUNCT
ecletica-1369	335	1	2011	2011	NUM
ecletica-1369	335	2	,	,	PUNCT
ecletica-1369	335	3	12	12	NUM
ecletica-1369	335	4	(	(	PUNCT
ecletica-1369	335	5	2	2	NUM
ecletica-1369	335	6	)	)	PUNCT
ecletica-1369	335	7	,	,	PUNCT
ecletica-1369	335	8	394	394	NUM
ecletica-1369	335	9	–	–	PUNCT
ecletica-1369	335	10	403	403	NUM
ecletica-1369	335	11	.	.	PUNCT
ecletica-1369	336	1	https://doi.org/10.1016/j.orgel.2010.11.025	https://doi.org/10.1016/j.orgel.2010.11.025	NOUN
ecletica-1369	336	2	sun	sun	NOUN
ecletica-1369	336	3	,	,	PUNCT
ecletica-1369	336	4	f.	f.	PROPN
ecletica-1369	336	5	;	;	PUNCT
ecletica-1369	336	6	jin	jin	PROPN
ecletica-1369	336	7	,	,	PUNCT
ecletica-1369	336	8	r.	r.	PROPN
ecletica-1369	336	9	dft	dft	PROPN
ecletica-1369	336	10	and	and	CCONJ
ecletica-1369	336	11	td	td	PROPN
ecletica-1369	336	12	-	-	PUNCT
ecletica-1369	336	13	dft	dft	NOUN
ecletica-1369	336	14	study	study	NOUN
ecletica-1369	336	15	on	on	ADP
ecletica-1369	336	16	the	the	DET
ecletica-1369	336	17	optical	optical	ADJ
ecletica-1369	336	18	and	and	CCONJ
ecletica-1369	336	19	electronic	electronic	ADJ
ecletica-1369	336	20	properties	property	NOUN
ecletica-1369	336	21	of	of	ADP
ecletica-1369	336	22	derivatives	derivative	NOUN
ecletica-1369	336	23	of	of	ADP
ecletica-1369	336	24	1	1	NUM
ecletica-1369	336	25	,	,	PUNCT
ecletica-1369	336	26	4	4	NUM
ecletica-1369	336	27	-	-	PUNCT
ecletica-1369	336	28	bis	bis	ADJ
ecletica-1369	336	29	(	(	PUNCT
ecletica-1369	336	30	2	2	NUM
ecletica-1369	336	31	-	-	PUNCT
ecletica-1369	336	32	substituted1	substituted1	NOUN
ecletica-1369	336	33	,	,	PUNCT
ecletica-1369	336	34	3	3	NUM
ecletica-1369	336	35	,	,	PUNCT
ecletica-1369	336	36	4	4	NUM
ecletica-1369	336	37	-	-	PUNCT
ecletica-1369	336	38	oxadiazole	oxadiazole	NOUN
ecletica-1369	336	39	)	)	PUNCT
ecletica-1369	336	40	benzene	benzene	NOUN
ecletica-1369	336	41	.	.	PUNCT
ecletica-1369	337	1	arab	arab	PROPN
ecletica-1369	337	2	.	.	PUNCT
ecletica-1369	338	1	j.	j.	PROPN
ecletica-1369	338	2	chem	chem	PROPN
ecletica-1369	338	3	.	.	PUNCT
ecletica-1369	339	1	2017	2017	NUM
ecletica-1369	339	2	,	,	PUNCT
ecletica-1369	339	3	10	10	NUM
ecletica-1369	339	4	(	(	PUNCT
ecletica-1369	339	5	suppl	suppl	ADJ
ecletica-1369	339	6	.	.	PROPN
ecletica-1369	340	1	2	2	NUM
ecletica-1369	340	2	)	)	PUNCT
ecletica-1369	340	3	,	,	PUNCT
ecletica-1369	340	4	s2988	s2988	PROPN
ecletica-1369	340	5	–	–	PUNCT
ecletica-1369	340	6	s2993	s2993	NOUN
ecletica-1369	340	7	.	.	PUNCT
ecletica-1369	341	1	https://doi.org/10.1016/j.arabjc.2013.11.037	https://doi.org/10.1016/j.arabjc.2013.11.037	NUM
ecletica-1369	341	2	https://revista.iq.unesp.br/index.php/ecletica	https://revista.iq.unesp.br/index.php/ecletica	PROPN
ecletica-1369	341	3	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	https://doi.org/10.26850/1678-4618eqj.v47.4.2022.p55-68	VERB
ecletica-1369	341	4	https://doi.org/10.1002/adfm.200700713	https://doi.org/10.1002/adfm.200700713	NOUN
ecletica-1369	341	5	https://doi.org/10.1002/adfm.200700713	https://doi.org/10.1002/adfm.200700713	NOUN
ecletica-1369	341	6	https://doi.org/10.1002/adfm.200600171	https://doi.org/10.1002/adfm.200600171	NOUN
ecletica-1369	341	7	https://doi.org/10.1002/adfm.200600171	https://doi.org/10.1002/adfm.200600171	NOUN
ecletica-1369	341	8	https://doi.org/10.1002/adfm.200600171	https://doi.org/10.1002/adfm.200600171	NOUN
ecletica-1369	341	9	https://doi.org/10.1002/adfm.200600171	https://doi.org/10.1002/adfm.200600171	NOUN
ecletica-1369	341	10	https://doi.org/10.1002/adfm.200600171	https://doi.org/10.1002/adfm.200600171	NOUN
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ecletica-1369	341	13	https://doi.org/10.1016/j.trechm.2019.08.001	https://doi.org/10.1016/j.trechm.2019.08.001	PROPN
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ecletica-1369	341	17	https://doi.org/10.1021/j100345a040	https://doi.org/10.1021/j100345a040	PROPN
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ecletica-1369	341	19	https://doi.org/10.1088/0957-4484/24/48/484001	https://doi.org/10.1088/0957-4484/24/48/484001	PROPN
ecletica-1369	341	20	https://doi.org/10.1088/0957-4484/24/48/484001	https://doi.org/10.1088/0957-4484/24/48/484001	PROPN
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ecletica-1369	342	2	https://doi.org/10.1088/0957-4484/24/48/484001	https://doi.org/10.1088/0957-4484/24/48/484001	PROPN
ecletica-1369	342	3	https://doi.org/10.1063/1.470985	https://doi.org/10.1063/1.470985	X
ecletica-1369	342	4	https://doi.org/10.1063/1.470985	https://doi.org/10.1063/1.470985	X
ecletica-1369	342	5	https://doi.org/10.1063/1.470985	https://doi.org/10.1063/1.470985	X
ecletica-1369	342	6	https://doi.org/10.1063/1.470985	https://doi.org/10.1063/1.470985	PROPN
ecletica-1369	342	7	https://doi.org/10.1063/1.460447	https://doi.org/10.1063/1.460447	PROPN
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ecletica-1369	342	9	https://doi.org/10.1063/1.460447	https://doi.org/10.1063/1.460447	PROPN
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ecletica-1369	342	12	http://hdl.handle.net/1866/10654	http://hdl.handle.net/1866/10654	PROPN
ecletica-1369	342	13	http://hdl.handle.net/1866/10654	http://hdl.handle.net/1866/10654	PROPN
ecletica-1369	342	14	http://hdl.handle.net/1866/10654	http://hdl.handle.net/1866/10654	PROPN
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ecletica-1369	342	17	https://doi.org/10.1002/jcc.1058	https://doi.org/10.1002/jcc.1058	VERB
ecletica-1369	342	18	https://doi.org/10.1002/jcc.1058	https://doi.org/10.1002/jcc.1058	PROPN
ecletica-1369	342	19	https://doi.org/10.1063/1.469104	https://doi.org/10.1063/1.469104	PROPN
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ecletica-1369	342	23	https://doi.org/10.1063/1.469104	https://doi.org/10.1063/1.469104	PROPN
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