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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	27-Sep-2021	SCO_OPBE_S3_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UOPBE	DEF2TZVP	-2865.88102844; Eh
	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_S7_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Minimum	UB3LYP	DEF2TZVP	-5117.50524376; 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_S6_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Minimum	UB3LYP	DEF2TZVP	-3114.14175826; 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
	27-Sep-2021	SCO_B3LYP_S5_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UB3LYP	DEF2TZVP	-2709.02048842; Eh
	27-Sep-2021	SCO_M06L_S2_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Minimum	UM06L	DEF2TZVP	-4399.59381990; Eh

Results 361-370 of 417 (Search time: 0.003 seconds).