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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	14-Mar-2024	/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M18	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-1948.4987251; Eh
	14-Mar-2024	/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M23	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-1147.9645167; 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
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ Ru9_11	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2056.9002513; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ Ru20_9	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2449.5114292; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ pyridine	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-247.8995485; Eh
	6-Oct-2023	/SP_PBEPBE_GD3MBJ_C6H6 Ru10_11	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2056.8776536; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ 9	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-1238.3599649; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ styrene	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-309.2718968; Eh
	6-Oct-2023	/GeomOpt_PBEPBE_GD3MBJ Ru10_11	Foscato, Marco; Giovanni, Occhipinti; Sondre H., Hopen Eliasson; Vidar R., Jensen	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2056.8776536; Eh

Results 101-110 of 118 (Search time: 0.001 seconds).