id	sid	tid	token	lemma	pos
wm117m04m2p	1	1	the	the	DET
wm117m04m2p	1	2	objective	objective	NOUN
wm117m04m2p	1	3	of	of	ADP
wm117m04m2p	1	4	this	this	DET
wm117m04m2p	1	5	work	work	NOUN
wm117m04m2p	1	6	is	be	AUX
wm117m04m2p	1	7	to	to	PART
wm117m04m2p	1	8	compare	compare	VERB
wm117m04m2p	1	9	the	the	DET
wm117m04m2p	1	10	various	various	ADJ
wm117m04m2p	1	11	adsorbate	adsorbate	NOUN
wm117m04m2p	1	12	free	free	ADJ
wm117m04m2p	1	13	energy	energy	NOUN
wm117m04m2p	1	14	approximations	approximation	NOUN
wm117m04m2p	1	15	by	by	ADP
wm117m04m2p	1	16	comparing	compare	VERB
wm117m04m2p	1	17	them	they	PRON
wm117m04m2p	1	18	against	against	ADP
wm117m04m2p	1	19	a	a	DET
wm117m04m2p	1	20	full	full	ADJ
wm117m04m2p	1	21	pes	pe	NOUN
wm117m04m2p	1	22	sampling	sampling	NOUN
wm117m04m2p	1	23	method	method	NOUN
wm117m04m2p	1	24	.	.	PUNCT
wm117m04m2p	2	1	furthermore	furthermore	ADV
wm117m04m2p	2	2	,	,	PUNCT
wm117m04m2p	2	3	we	we	PRON
wm117m04m2p	2	4	show	show	VERB
wm117m04m2p	2	5	the	the	DET
wm117m04m2p	2	6	impact	impact	NOUN
wm117m04m2p	2	7	of	of	ADP
wm117m04m2p	2	8	free	free	ADJ
wm117m04m2p	2	9	energy	energy	NOUN
wm117m04m2p	2	10	model	model	NOUN
wm117m04m2p	2	11	choice	choice	NOUN
wm117m04m2p	2	12	on	on	ADP
wm117m04m2p	2	13	equilibrium	equilibrium	NOUN
wm117m04m2p	2	14	predictions	prediction	NOUN
wm117m04m2p	2	15	of	of	ADP
wm117m04m2p	2	16	a	a	DET
wm117m04m2p	2	17	catalytic	catalytic	ADJ
wm117m04m2p	2	18	reaction	reaction	NOUN
wm117m04m2p	2	19	model	model	NOUN
wm117m04m2p	2	20	involving	involve	VERB
wm117m04m2p	2	21	polyatomic	polyatomic	ADJ
wm117m04m2p	2	22	adsorbates	adsorbate	NOUN
wm117m04m2p	2	23	.	.	PUNCT
wm117m04m2p	3	1	focus	focus	NOUN
wm117m04m2p	3	2	is	be	AUX
wm117m04m2p	3	3	placed	place	VERB
wm117m04m2p	3	4	on	on	ADP
wm117m04m2p	3	5	comparing	compare	VERB
wm117m04m2p	3	6	the	the	DET
wm117m04m2p	3	7	harmonic	harmonic	NOUN
wm117m04m2p	3	8	oscillator	oscillator	NOUN
wm117m04m2p	3	9	and	and	CCONJ
wm117m04m2p	3	10	free	free	ADJ
wm117m04m2p	3	11	translator	translator	NOUN
wm117m04m2p	3	12	(	(	PUNCT
wm117m04m2p	3	13	ho	ho	PROPN
wm117m04m2p	3	14	,	,	PUNCT
wm117m04m2p	3	15	ft	ft	NOUN
wm117m04m2p	3	16	)	)	PUNCT
wm117m04m2p	3	17	free	free	ADJ
wm117m04m2p	3	18	energy	energy	NOUN
wm117m04m2p	3	19	approximations	approximation	NOUN
wm117m04m2p	3	20	.	.	PUNCT
wm117m04m2p	4	1	the	the	DET
wm117m04m2p	4	2	procedure	procedure	NOUN
wm117m04m2p	4	3	for	for	ADP
wm117m04m2p	4	4	performing	perform	VERB
wm117m04m2p	4	5	dft	dft	NOUN
wm117m04m2p	4	6	calculations	calculation	NOUN
wm117m04m2p	4	7	and	and	CCONJ
wm117m04m2p	4	8	computing	compute	VERB
wm117m04m2p	4	9	free	free	ADJ
wm117m04m2p	4	10	energies	energy	NOUN
wm117m04m2p	4	11	will	will	AUX
wm117m04m2p	4	12	be	be	AUX
wm117m04m2p	4	13	given	give	VERB
wm117m04m2p	4	14	initially	initially	ADV
wm117m04m2p	4	15	.	.	PUNCT
wm117m04m2p	5	1	next	next	ADV
wm117m04m2p	5	2	,	,	PUNCT
wm117m04m2p	5	3	the	the	DET
wm117m04m2p	5	4	formulation	formulation	NOUN
wm117m04m2p	5	5	of	of	ADP
wm117m04m2p	5	6	the	the	DET
wm117m04m2p	5	7	equations	equation	NOUN
wm117m04m2p	5	8	of	of	ADP
wm117m04m2p	5	9	an	an	DET
wm117m04m2p	5	10	equilibrium	equilibrium	NOUN
wm117m04m2p	5	11	model	model	NOUN
wm117m04m2p	5	12	will	will	AUX
wm117m04m2p	5	13	be	be	AUX
wm117m04m2p	5	14	derived	derive	VERB
wm117m04m2p	5	15	and	and	CCONJ
wm117m04m2p	5	16	we	we	PRON
wm117m04m2p	5	17	will	will	AUX
wm117m04m2p	5	18	explain	explain	VERB
wm117m04m2p	5	19	possible	possible	ADJ
wm117m04m2p	5	20	limitations	limitation	NOUN
wm117m04m2p	5	21	of	of	ADP
wm117m04m2p	5	22	the	the	DET
wm117m04m2p	5	23	model	model	NOUN
wm117m04m2p	5	24	due	due	ADP
wm117m04m2p	5	25	to	to	ADP
wm117m04m2p	5	26	the	the	DET
wm117m04m2p	5	27	assumptions	assumption	NOUN
wm117m04m2p	5	28	used	use	VERB
wm117m04m2p	5	29	.	.	PUNCT
wm117m04m2p	6	1	finally	finally	ADV
wm117m04m2p	6	2	,	,	PUNCT
wm117m04m2p	6	3	we	we	PRON
wm117m04m2p	6	4	will	will	AUX
wm117m04m2p	6	5	quantify	quantify	VERB
wm117m04m2p	6	6	the	the	DET
wm117m04m2p	6	7	differences	difference	NOUN
wm117m04m2p	6	8	in	in	ADP
wm117m04m2p	6	9	adsorbate	adsorbate	ADJ
wm117m04m2p	6	10	free	free	ADJ
wm117m04m2p	6	11	energy	energy	NOUN
wm117m04m2p	6	12	approximations	approximation	NOUN
wm117m04m2p	6	13	by	by	ADP
wm117m04m2p	6	14	means	mean	NOUN
wm117m04m2p	6	15	of	of	ADP
wm117m04m2p	6	16	direct	direct	ADJ
wm117m04m2p	6	17	comparison	comparison	NOUN
wm117m04m2p	6	18	and	and	CCONJ
wm117m04m2p	6	19	by	by	ADP
wm117m04m2p	6	20	looking	look	VERB
wm117m04m2p	6	21	at	at	ADP
wm117m04m2p	6	22	the	the	DET
wm117m04m2p	6	23	sensitivity	sensitivity	NOUN
wm117m04m2p	6	24	of	of	ADP
wm117m04m2p	6	25	model	model	NOUN
wm117m04m2p	6	26	results	result	NOUN
wm117m04m2p	6	27	to	to	PART
wm117m04m2p	6	28	free	free	ADJ
wm117m04m2p	6	29	energy	energy	NOUN
wm117m04m2p	6	30	calculation	calculation	NOUN
wm117m04m2p	6	31	method	method	NOUN
wm117m04m2p	6	32	.	.	PUNCT