id	sid	eid	entity	type
bibechana-58684	2	1	21	DATE
bibechana-58684	2	2	1	CARDINAL
bibechana-58684	2	3	april 2024	DATE
bibechana-58684	2	4	23–36	CARDINAL
bibechana-58684	2	5	2091-0762	CARDINAL
bibechana-58684	2	6	2382-5340	CARDINAL
bibechana-58684	2	7	mahendra morang a. m.	PERSON
bibechana-58684	3	1	first	ORDINAL
bibechana-58684	3	2	susmita limbu	ORG
bibechana-58684	3	3	ojha	GPE
bibechana-58684	3	4	rishi ram ghimire	ORG
bibechana-58684	3	5	krishna bahadur	PERSON
bibechana-58684	3	6	department of physics	ORG
bibechana-58684	3	7	patan multiple	ORG
bibechana-58684	5	1	krishna.rai@pmc.tu.edu.np	PERSON
bibechana-58684	5	2	first	ORDINAL
bibechana-58684	7	1	dft	ORG
bibechana-58684	9	1	266.8358066 hartree	QUANTITY
bibechana-58684	12	1	gibb	PERSON
bibechana-58684	13	1	5.6137 ev	MONEY
bibechana-58684	18	1	september 20	DATE
bibechana-58684	18	2	2023	CARDINAL
bibechana-58684	18	3	december 10	DATE
bibechana-58684	18	4	2023	CARDINAL
bibechana-58684	18	5	december 16	DATE
bibechana-58684	18	6	2023	CARDINAL
bibechana-58684	18	7	nc	GPE
bibechana-58684	19	1	23	CARDINAL
bibechana-58684	19	2	http://nepjol.info/index.php/bibechana krishna.rai@pmc.tu.edu.np https://doi.org/10.3126/bibechana.v21i1.58684	PERSON
bibechana-58684	19	3	susmita limbu	PERSON
bibechana-58684	20	1	21	DATE
bibechana-58684	20	2	2024	CARDINAL
bibechana-58684	20	3	23	CARDINAL
bibechana-58684	20	4	first	ORDINAL
bibechana-58684	21	1	1859	DATE
bibechana-58684	21	2	the beginning of the twentieth century	DATE
bibechana-58684	24	1	1–3	CARDINAL
bibechana-58684	25	1	two	CARDINAL
bibechana-58684	35	1	gustav e. lienhard	ORG
bibechana-58684	35	2	william p. jencks	PERSON
bibechana-58684	35	3	7	CARDINAL
bibechana-58684	38	1	8	CARDINAL
bibechana-58684	40	1	9	CARDINAL
bibechana-58684	41	1	laurence et al.	PERSON
bibechana-58684	44	1	10	CARDINAL
bibechana-58684	45	1	first	ORDINAL
bibechana-58684	46	1	cv	ORG
bibechana-58684	46	2	dft	ORG
bibechana-58684	48	1	dft	ORG
bibechana-58684	48	2	dft	ORG
bibechana-58684	50	1	6-311+g(d ′	TIME
bibechana-58684	54	1	six	CARDINAL
bibechana-58684	54	2	two	CARDINAL
bibechana-58684	54	3	one	CARDINAL
bibechana-58684	54	4	three	CARDINAL
bibechana-58684	54	5	two	CARDINAL
bibechana-58684	55	1	6-311g(d	CARDINAL
bibechana-58684	55	2	6-311	QUANTITY
bibechana-58684	59	1	dft	ORG
bibechana-58684	60	1	susmita limbu et al./	ORG
bibechana-58684	60	2	21	DATE
bibechana-58684	60	3	2024	CARDINAL
bibechana-58684	60	4	23	CARDINAL
bibechana-58684	61	1	first	ORDINAL
bibechana-58684	62	1	dft	ORG
bibechana-58684	63	1	11	CARDINAL
bibechana-58684	63	2	6-311+g(d ′	QUANTITY
bibechana-58684	63	3	three	CARDINAL
bibechana-58684	63	4	leeyang pair correlation functional b3lyp	ORG
bibechana-58684	64	1	12,13	CARDINAL
bibechana-58684	64	2	zero	CARDINAL
bibechana-58684	65	1	6.0	CARDINAL
bibechana-58684	67	1	14	CARDINAL
bibechana-58684	68	1	6-311+g(d ′	TIME
bibechana-58684	68	2	15	CARDINAL
bibechana-58684	69	1	cv	ORG
bibechana-58684	71	1	3	CARDINAL
bibechana-58684	71	2	3.1	CARDINAL
bibechana-58684	71	3	three	CARDINAL
bibechana-58684	71	4	16	CARDINAL
bibechana-58684	72	1	first	ORDINAL
bibechana-58684	73	1	1(a	CARDINAL
bibechana-58684	74	1	1(a	CARDINAL
bibechana-58684	76	1	17	CARDINAL
bibechana-58684	77	1	3.2	CARDINAL
bibechana-58684	80	1	18	CARDINAL
bibechana-58684	84	1	2	CARDINAL
bibechana-58684	84	2	1257.5142	ORDINAL
bibechana-58684	84	3	cm−1	LOC
bibechana-58684	85	1	3	CARDINAL
bibechana-58684	85	2	cm−1	LOC
bibechana-58684	85	3	3105.5663	CARDINAL
bibechana-58684	85	4	1382.2427	CARDINAL
bibechana-58684	86	1	4	CARDINAL
bibechana-58684	86	2	3331.3231	CARDINAL
bibechana-58684	86	3	2201.8905	CARDINAL
bibechana-58684	86	4	282.2516	CARDINAL
bibechana-58684	87	1	5	CARDINAL
bibechana-58684	87	2	3179.0767	CARDINAL
bibechana-58684	87	3	3122.3869 cm−1	ORG
bibechana-58684	87	4	3041.8403	CARDINAL
bibechana-58684	87	5	cm−1	LOC
bibechana-58684	87	6	999.1881	CARDINAL
bibechana-58684	88	1	o	DATE
bibechana-58684	88	2	π − π	ORG
bibechana-58684	89	1	o	DATE
bibechana-58684	90	1	1680–1715	CARDINAL
bibechana-58684	91	1	2	CARDINAL
bibechana-58684	91	2	o	DATE
bibechana-58684	91	3	1816.9839	CARDINAL
bibechana-58684	92	1	3	CARDINAL
bibechana-58684	92	2	1789.4345	CARDINAL
bibechana-58684	93	1	4	CARDINAL
bibechana-58684	93	2	o	DATE
bibechana-58684	93	3	1747.0313	CARDINAL
bibechana-58684	94	1	5	CARDINAL
bibechana-58684	95	1	susmita limbu et al./	ORG
bibechana-58684	95	2	21	DATE
bibechana-58684	95	3	2024	CARDINAL
bibechana-58684	95	4	23	CARDINAL
bibechana-58684	96	1	26	CARDINAL
bibechana-58684	96	2	788.341	CARDINAL
bibechana-58684	96	3	1089.4461	CARDINAL
bibechana-58684	96	4	5	CARDINAL
bibechana-58684	96	5	4	CARDINAL
bibechana-58684	96	6	483.3359	CARDINAL
bibechana-58684	103	1	∆g	ORG
bibechana-58684	109	1	1	CARDINAL
bibechana-58684	110	1	2	CARDINAL
bibechana-58684	111	1	susmita limbu et al./	ORG
bibechana-58684	111	2	21	DATE
bibechana-58684	111	3	2024	CARDINAL
bibechana-58684	111	4	23	CARDINAL
bibechana-58684	111	5	27	CARDINAL
bibechana-58684	111	6	3	CARDINAL
bibechana-58684	112	1	4	CARDINAL
bibechana-58684	113	1	5	CARDINAL
bibechana-58684	114	1	susmita limbu et al./	ORG
bibechana-58684	114	2	21	DATE
bibechana-58684	114	3	2024	CARDINAL
bibechana-58684	114	4	23	CARDINAL
bibechana-58684	114	5	3.3	CARDINAL
bibechana-58684	116	1	gibbs free energy	ORG
bibechana-58684	116	2	cv	ORG
bibechana-58684	117	1	298.15 k	QUANTITY
bibechana-58684	117	2	one	CARDINAL
bibechana-58684	118	1	6	CARDINAL
bibechana-58684	118	2	7	DATE
bibechana-58684	118	3	8	DATE
bibechana-58684	118	4	9	CARDINAL
bibechana-58684	118	5	cv	ORG
bibechana-58684	119	1	10 k to	QUANTITY
bibechana-58684	119	2	50 k	QUANTITY
bibechana-58684	119	3	50	CARDINAL
bibechana-58684	119	4	500	CARDINAL
bibechana-58684	119	5	cv	ORG
bibechana-58684	119	6	10	CARDINAL
bibechana-58684	119	7	500	CARDINAL
bibechana-58684	120	1	6	CARDINAL
bibechana-58684	120	2	7	DATE
bibechana-58684	120	3	8	DATE
bibechana-58684	120	4	9	CARDINAL
bibechana-58684	121	1	19	CARDINAL
bibechana-58684	122	1	20	CARDINAL
bibechana-58684	124	1	the s and h	ORG
bibechana-58684	125	1	6	CARDINAL
bibechana-58684	126	1	susmita limbu et al./	ORG
bibechana-58684	126	2	21	DATE
bibechana-58684	126	3	2024	CARDINAL
bibechana-58684	126	4	23	CARDINAL
bibechana-58684	126	5	7	CARDINAL
bibechana-58684	127	1	8	CARDINAL
bibechana-58684	128	1	9	CARDINAL
bibechana-58684	129	1	susmita limbu et	PERSON
bibechana-58684	129	2	21	DATE
bibechana-58684	129	3	2024	CARDINAL
bibechana-58684	129	4	23	CARDINAL
bibechana-58684	129	5	3.4	CARDINAL
bibechana-58684	129	6	homo-lumo	ORG
bibechana-58684	130	1	21	CARDINAL
bibechana-58684	137	1	22	CARDINAL
bibechana-58684	137	2	23	CARDINAL
bibechana-58684	138	1	first	ORDINAL
bibechana-58684	138	2	one	CARDINAL
bibechana-58684	138	3	24	CARDINAL
bibechana-58684	139	1	10(a	CARDINAL
bibechana-58684	139	2	three	CARDINAL
bibechana-58684	139	3	dft	ORG
bibechana-58684	140	1	10(a	CARDINAL
bibechana-58684	142	1	10(a	CARDINAL
bibechana-58684	142	2	10(b	CARDINAL
bibechana-58684	143	1	10(b	CARDINAL
bibechana-58684	145	1	10(d	CARDINAL
bibechana-58684	146	1	10(d	CARDINAL
bibechana-58684	147	1	7.4222 ev	MONEY
bibechana-58684	147	2	5.9443 ev	MONEY
bibechana-58684	148	1	second	ORDINAL
bibechana-58684	153	1	ea	CARDINAL
bibechana-58684	154	1	1	CARDINAL
bibechana-58684	154	2	koopman	PERSON
bibechana-58684	154	3	25–27	CARDINAL
bibechana-58684	155	1	1	CARDINAL
bibechana-58684	155	2	2	CARDINAL
bibechana-58684	156	1	3	CARDINAL
bibechana-58684	156	2	4	CARDINAL
bibechana-58684	156	3	5	CARDINAL
bibechana-58684	157	1	21	DATE
bibechana-58684	157	2	2024	CARDINAL
bibechana-58684	157	3	23-36 31	DATE
bibechana-58684	157	4	7.6379	CARDINAL
bibechana-58684	158	1	28	CARDINAL
bibechana-58684	159	1	3.140605 ev	MONEY
bibechana-58684	160	1	0.318409	CARDINAL
bibechana-58684	161	1	1	CARDINAL
bibechana-58684	167	1	1	CARDINAL
bibechana-58684	167	2	4.698725 ev	MONEY
bibechana-58684	168	1	0.489788 ev	MONEY
bibechana-58684	169	1	1.5 ev	PERCENT
bibechana-58684	169	2	less than 0.8	CARDINAL
bibechana-58684	170	1	29	CARDINAL
bibechana-58684	171	1	1	CARDINAL
bibechana-58684	171	2	1.570297	CARDINAL
bibechana-58684	171	3	0.137800	CARDINAL
bibechana-58684	172	1	1.486082	CARDINAL
bibechana-58684	172	2	1.403425	ORG
bibechana-58684	175	1	1	CARDINAL
bibechana-58684	175	2	3.649608 ev	MONEY
bibechana-58684	175	3	0.318409 ev	MONEY
bibechana-58684	178	1	10	CARDINAL
bibechana-58684	178	2	dft	ORG
bibechana-58684	179	1	3.5	CARDINAL
bibechana-58684	180	1	30	CARDINAL
bibechana-58684	182	1	one	CARDINAL
bibechana-58684	183	1	ed iso-surface	PERSON
bibechana-58684	184	1	11(a	DATE
bibechana-58684	184	2	9.963e-3 to 9.963e-3	CARDINAL
bibechana-58684	185	1	11(b	CARDINAL
bibechana-58684	185	2	susmita limbu	ORG
bibechana-58684	185	3	21	DATE
bibechana-58684	185	4	2024	CARDINAL
bibechana-58684	185	5	23	CARDINAL
bibechana-58684	185	6	4.309e-2	CARDINAL
bibechana-58684	188	1	31	CARDINAL
bibechana-58684	189	1	5.283e-2	CARDINAL
bibechana-58684	189	2	12(a	CARDINAL
bibechana-58684	190	1	13(a	CARDINAL
bibechana-58684	191	1	6.020e-2	CARDINAL
bibechana-58684	191	2	a. u.	PERSON
bibechana-58684	193	1	11(a	CARDINAL
bibechana-58684	193	2	12(a	CARDINAL
bibechana-58684	193	3	13(a	DATE
bibechana-58684	194	1	11(b	CARDINAL
bibechana-58684	194	2	12(b	TIME
bibechana-58684	194	3	13(b	DATE
bibechana-58684	194	4	14(b	DATE
bibechana-58684	195	1	11(a	CARDINAL
bibechana-58684	195	2	12(a	CARDINAL
bibechana-58684	195	3	13(a	DATE
bibechana-58684	195	4	14(a	CARDINAL
bibechana-58684	196	1	11(c	CARDINAL
bibechana-58684	196	2	12(c	CARDINAL
bibechana-58684	196	3	13(c	TIME
bibechana-58684	196	4	14(c	CARDINAL
bibechana-58684	197	1	1	CARDINAL
bibechana-58684	198	1	2.972165	CARDINAL
bibechana-58684	198	2	3.140605	MONEY
bibechana-58684	198	3	0.274002	MONEY
bibechana-58684	198	4	3.877755	ORG
bibechana-58684	198	5	1.486082	CARDINAL
bibechana-58684	198	6	1.403425 0.137800	CARDINAL
bibechana-58684	198	7	0.318409	MONEY
bibechana-58684	198	8	3.649608	MONEY
bibechana-58684	198	9	11	CARDINAL
bibechana-58684	198	10	dft	ORG
bibechana-58684	199	1	susmita limbu et al./	ORG
bibechana-58684	199	2	21	DATE
bibechana-58684	199	3	2024	CARDINAL
bibechana-58684	199	4	23	CARDINAL
bibechana-58684	199	5	33	CARDINAL
bibechana-58684	199	6	12	CARDINAL
bibechana-58684	199	7	dft	ORG
bibechana-58684	200	1	13	CARDINAL
bibechana-58684	200	2	dft	ORG
bibechana-58684	201	1	14	CARDINAL
bibechana-58684	201	2	dft	PRODUCT
bibechana-58684	202	1	3.6	CARDINAL
bibechana-58684	202	2	31	CARDINAL
bibechana-58684	202	3	32	CARDINAL
bibechana-58684	203	1	3.0.2	CARDINAL
bibechana-58684	204	1	33	CARDINAL
bibechana-58684	205	1	two	CARDINAL
bibechana-58684	207	1	zero	CARDINAL
bibechana-58684	208	1	34	CARDINAL
bibechana-58684	210	1	15	CARDINAL
bibechana-58684	210	2	20	CARDINAL
bibechana-58684	210	3	half	CARDINAL
bibechana-58684	210	4	0.3 ev.	PERCENT
bibechana-58684	211	1	15(a	DATE
bibechana-58684	211	2	5.9176 ev	MONEY
bibechana-58684	211	3	5.9443	CARDINAL
bibechana-58684	211	4	5.9176 ev	MONEY
bibechana-58684	211	5	susmita limbu et	ORG
bibechana-58684	212	1	21	DATE
bibechana-58684	212	2	2024	CARDINAL
bibechana-58684	212	3	23	CARDINAL
bibechana-58684	212	4	34	CARDINAL
bibechana-58684	213	1	15(b	CARDINAL
bibechana-58684	213	2	6.2825	CARDINAL
bibechana-58684	213	3	6.2812 ev	MONEY
bibechana-58684	214	1	15(c	DATE
bibechana-58684	214	2	5.6233	CARDINAL
bibechana-58684	214	3	5.6137 ev	MONEY
bibechana-58684	215	1	15(d	CARDINAL
bibechana-58684	215	2	7.1838	CARDINAL
bibechana-58684	215	3	7.4222 ev	MONEY
bibechana-58684	217	1	15	CARDINAL
bibechana-58684	217	2	o	DATE
bibechana-58684	218	1	15	CARDINAL
bibechana-58684	218	2	6-311+g(d ′	QUANTITY
bibechana-58684	219	1	4	CARDINAL
bibechana-58684	220	1	6-311+g(d ′	TIME
bibechana-58684	222	1	gibbs free energy	ORG
bibechana-58684	232	1	the homo-lumo energy gaps	ORG
bibechana-58684	234	1	1	CARDINAL
bibechana-58684	234	2	h. r. gerberich	PERSON
bibechana-58684	234	3	c. g.	PERSON
bibechana-58684	236	1	john wiley & sons ltd	ORG
bibechana-58684	236	2	1st	ORDINAL
bibechana-58684	236	3	2001	DATE
bibechana-58684	237	1	2	CARDINAL
bibechana-58684	237	2	s. patai	PERSON
bibechana-58684	239	1	john wiley & sons ltd	ORG
bibechana-58684	239	2	1st	ORDINAL
bibechana-58684	239	3	1966	DATE
bibechana-58684	240	1	3	CARDINAL
bibechana-58684	240	2	r. pilli	PERSON
bibechana-58684	240	3	costa	GPE
bibechana-58684	240	4	s. pinheiro	PERSON
bibechana-58684	241	1	susmita limbu et al./	ORG
bibechana-58684	241	2	21	DATE
bibechana-58684	241	3	2024	CARDINAL
bibechana-58684	241	4	23	CARDINAL
bibechana-58684	242	1	1st	ORDINAL
bibechana-58684	242	2	2022	CARDINAL
bibechana-58684	243	1	4	CARDINAL
bibechana-58684	243	2	l. c. becker et	PERSON
bibechana-58684	244	1	polymethyl methacrylate	ORG
bibechana-58684	244	2	pmma	ORG
bibechana-58684	245	1	j. toxicol	PERSON
bibechana-58684	245	2	30(3):54s	CARDINAL
bibechana-58684	245	3	65s, 2011	DATE
bibechana-58684	246	1	5	CARDINAL
bibechana-58684	246	2	e. c. friedrich	PERSON
bibechana-58684	246	3	e. j. lewis.	PERSON
bibechana-58684	248	1	j. org	ORG
bibechana-58684	248	2	55(8):2491	CARDINAL
bibechana-58684	248	3	2494	CARDINAL
bibechana-58684	248	4	1990	DATE
bibechana-58684	249	1	6	CARDINAL
bibechana-58684	249	2	e. graczova	PERSON
bibechana-58684	249	3	b. sulgan	PERSON
bibechana-58684	249	4	s. barabas	PERSON
bibechana-58684	252	1	sci	ORG
bibechana-58684	253	1	eng	GPE
bibechana-58684	253	2	12(2):670–682	DATE
bibechana-58684	253	3	2018	DATE
bibechana-58684	254	1	7	CARDINAL
bibechana-58684	254	2	g. e. lienhard	PERSON
bibechana-58684	254	3	w. p. jencks	PERSON
bibechana-58684	257	1	j. am	PERSON
bibechana-58684	260	1	8	CARDINAL
bibechana-58684	262	1	148:3432–3451	CARDINAL
bibechana-58684	262	2	2023	CARDINAL
bibechana-58684	263	1	9	CARDINAL
bibechana-58684	263	2	j. l. meeks	PERSON
bibechana-58684	263	3	h. j. maria	PERSON
bibechana-58684	263	4	s. p. mcglynn	PERSON
bibechana-58684	263	5	photoelectron	ORG
bibechana-58684	263	6	alpha.-dicarbonyls	LOC
bibechana-58684	263	7	75(5):603–610	CARDINAL
bibechana-58684	263	8	1975	DATE
bibechana-58684	264	1	10	CARDINAL
bibechana-58684	264	2	c. laurence	PERSON
bibechana-58684	264	3	g. guiheneuf	PERSON
bibechana-58684	266	1	j. am	PERSON
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