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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	30-May-2021	/benchmarking/wB97X_D_6_311+Gdp NiCODdppf	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RwB97XD	6-311+G(D,P) GENECP	-5079.2464923; Eh
	30-May-2021	/benchmarking/M06_6_311+Gdp NiBrHdppf	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-7341.0558337; Eh
	30-May-2021	/reaction_profiles/PC6H4Me3 NidppfPC6H4Me3BrR	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-8804.3780828; Eh
	30-May-2021	/reaction_profiles/PC6H4Me3 NidppfPC6H4Me3	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-5920.2289598; Eh
	30-May-2021	/benchmarking/M06_6_311+Gdp styrene	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-309.4773324; Eh
	30-May-2021	/benchmarking/MN15_6_311+Gdp Nidppf2	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	-	6-311+G(D,P) GENECP	-8024.0821745; Eh
	30-May-2021	/reaction_profiles/PC6H4Me3 NiBrdppfPC6H4Me3+rad_triplet	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8804.3687382; Eh
	30-May-2021	/benchmarking/M06_6_311+Gdp NiBrHdppfstyrene_isomer	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-7650.5434278; Eh
	30-May-2021	/benchmarking/M06_6_311+Gdp NiBrdppf2+rad_oss	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-10908.6930663; Eh
	30-May-2021	/benchmarking/B3LYP_D3_6_311+Gdp dppf	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G(D,P) GENECP	-3259.3991942; Eh

Results 551-560 of 679 (Search time: 0.003 seconds).