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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Jan-2021	Cat6	Kojasoy, Volga	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	UB3LYP	GENECP	-
	9-Jan-2021	Cat4	Kojasoy, Volga	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UB3LYP	GENECP	-
	9-Jan-2021	12d	Kojasoy, Volga	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UB3LYP	GENECP	-
	9-Jan-2021	R1-gas	Kojasoy, Volga	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UB3LYP	GENECP	-
	9-Jan-2021	RP1-cuhfacac	Kojasoy, Volga	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	UB3LYP	GENECP	-
	27-Sep-2021	SCO_B3LYP_S7_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UB3LYP	DEF2TZVP	-5117.50637882; Eh
	27-Sep-2021	SCO_B3LYP_S6_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UB3LYP	DEF2TZVP	-3114.14138391; Eh
	27-Sep-2021	SCO_B3LYP_S5_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UB3LYP	DEF2TZVP	-2709.01959956; Eh
	27-Sep-2021	SCO_B3LYP_S8_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UB3LYP	DEF2TZVP	-2791.18325126; Eh
	27-Sep-2021	SCO_B3LYP_S8_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UB3LYP	DEF2TZVP	-2791.18183607; Eh

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