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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_TPSSh_S4_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-2719.21273828; Eh
	27-Sep-2021	SCO_TPSSh_S4_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-2719.23061056; Eh
	27-Sep-2021	SCO_TPSSh_S12_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-4077.69180373; Eh
	27-Sep-2021	SCO_TPSSh_S12_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-4077.70787716; Eh
	27-Sep-2021	SCO_TPSSh_S11_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-8013.44778321; Eh
	27-Sep-2021	SCO_TPSSh_S14_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	GENECP	-3460.51818391; Eh
	27-Sep-2021	SCO_TPSSh_S13_LS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-2673.47021856; Eh
	27-Sep-2021	SCO_TPSSh_S13_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-2673.45201021; Eh
	27-Sep-2021	SCO_TPSSh_S18_HS	Vidal, Daniel	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	UTPSSh	DEF2TZVP	-2832.36173103; Eh
	3-May-2019	Co-16-VAC-freq	Craig, Michael	Gaussian; 09; ES64L-G09RevE.01	Single point Structure	UTPSSh	lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)	-1689.31086223; Eh

Results 601-610 of 697 (Search time: 0.002 seconds).