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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	4-Nov-2021	H_conf_4	Merrill, Amy	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31+G(D,P)	-
	4-Nov-2021	H_conf_2	Merrill, Amy	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31+G(D,P)	-
	19-Oct-2021	anti_C1_14_ap_48_-54	Merrill, Amy	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31+G(D,P)	-
	15-Oct-2021	/SP_M06L_GD3_CHCl3 M7	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06L	GENECP	-2632.39194122; Eh
	15-Oct-2021	/SP_M06L_GD3_CHCl3 ethylene	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06L	GEN	-78.6072974971; Eh
	15-Oct-2021	/SP_M06L_GD3_CHCl3 M30	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06L	GEN	-1811.66162941; Eh
	15-Oct-2021	/SP_M06L_GD3_CHCl3 M29	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06L	GEN	-2003.44025979; Eh
	15-Oct-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M26	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RPBEPBE	GENECP	-1888.91896812; Eh
	15-Oct-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M24	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RPBEPBE	GENECP	-2080.49903346; Eh
	14-Sep-2022	/PBE0 PBE0_cat-4	Ortuño Maqueda, Manuel Angel	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UPBE1PBE	SDD 6-31+G(D,P) 6-31G(D,P) GEN	-1118.03194683; Eh

Results 3441-3450 of 8124 (Search time: 0.005 seconds).