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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	15-Oct-2021	/GeomOpt_PBEPBE M79	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2541.4165354; Eh
	15-Oct-2021	/GeomOpt_PBEPBE M81	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2349.9747437; Eh
	15-Oct-2021	/GeomOpt_PBEPBE M87	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-1888.3899145; Eh
	15-Oct-2021	/GeomOpt_PBEPBE 2-Isopropoxy-5-nitrostyrene	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-706.5283714; Eh
	15-Oct-2021	/GeomOpt_PBEPBE ethylene	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-78.4683525; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ Ru20_11	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2135.4308435; Eh
	11-Dec-2023	/GeomOpt_OLYP_SMDbenzene_def2TZVPP A12	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; ROLYP	DEF2SVPP DEF2TZVPP	-1980.2432855; Eh
	11-Dec-2023	/GeomOpt_OLYP_SMDbenzene P4	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; ROLYP	LANL2MB LANL2DZ	-525.1005794; Eh
	11-Dec-2023	/GeomOpt_OLYP_SMDbenzene 9	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; ROLYP	LANL2MB LANL2DZ	-1402.3935813; Eh
	6-Oct-2023	/GeomOpt_OLYP_SP_B3LYP Ru8_7_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	-1901.7861568; Eh

Results 81-90 of 174 (Search time: 0.001 seconds).