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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Feb-2021	/GeomOpt_wB97XD pyridine	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RwB97XD	GEN	-248.2112174; Eh
	28-Feb-2021	/GeomOpt_wB97XD M29	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UHF; UwB97XD	GENECP GEN	-3959.2709204; Eh
	28-Feb-2021	/GeomOpt_wB97XD M28	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UwB97XD	GEN	-3959.28171426; Eh
	28-Feb-2021	/GeomOpt_wB97XD M34	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UwB97XD	GEN	-3880.66372559; Eh
	28-Feb-2021	/GeomOpt_wB97XD M26	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UHF; UwB97XD	GENECP GEN	-3959.2549317; Eh
	28-Feb-2021	/GeomOpt_wB97XD M27	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UHF; UwB97XD	GENECP GEN	-3959.2398976; Eh
	28-Feb-2021	/GeomOpt_wB97XD M14	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3959.2493957; Eh
	28-Feb-2021	/GeomOpt_wB97XD M12	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3959.2336556; Eh
	28-Feb-2021	/GeomOpt_wB97XD M7	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	GEN	-3959.23408203; Eh
	28-Feb-2021	/GeomOpt_wB97XD M6	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3959.211717; Eh

Results 371-380 of 462 (Search time: 0.001 seconds).