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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	6-Oct-2023	/SP_PBEPBE_GD3MBJ_C6H6 Ru9_11	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2057.31443748; Eh
	11-Dec-2023	/GeomOpt_OLYP_SMDbenzene_def2TZVPP P16	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; ROLYP	DEF2SVPP DEF2TZVPP	-1695.9481219; Eh
	11-Dec-2023	/GeomOpt_OLYP_SMDbenzene_def2TZVPP 9	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; ROLYP	DEF2SVPP DEF2TZVPP	-2294.600776; Eh
	6-Oct-2023	/GeomOpt_OLYP_SP_B3LYP Ru8_22_CH2O_PR2	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; ROLYP; RB3LYP	LANL2MB LANL2DZ LANL2DZ/AUTO GENECP	-1753.7336404; Eh
	6-Oct-2023	/GeomOpt_OLYP_SP_B3LYP Ru8_9_CH2O_PR2	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; ROLYP; RB3LYP	LANL2MB LANL2DZ LANL2DZ/AUTO GENECP	-1517.822554; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ Ru19_9	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2449.4612798; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ Ru9_9	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2370.9975069; Eh
	6-Oct-2023	/SP_PBEPBE_GD3MBJ_C6H6 Ru19_11	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2135.85961927; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ Ru19_11	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	GEN	-2135.42319136; Eh
	6-Oct-2023	/SP_PBEPBE_GD3MBJ_C6H6 9	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GEN	-1238.81575958; Eh

Results 341-350 of 396 (Search time: 0.001 seconds).