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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	30-May-2021	/reaction_profiles/PC6H4CF33 NidppfPC6H4CF33_HATS_triplet	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-9697.5559669; Eh
	30-May-2021	/reaction_profiles/PPh3 NidppfPPh3_HATS_triplet	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8686.4477273; Eh
	30-May-2021	/reaction_profiles/PC6H4CF33 NidppfPC6H4CF33	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-6813.4480793; Eh
	30-May-2021	/reaction_profiles/PPh3 NidppfPPh3BrR	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-8686.4929248; Eh
	30-May-2021	/reaction_profiles/PMe3 NidppfPMe3RBr	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-8111.5846724; Eh
	30-May-2021	/reaction_profiles/PMe3 NidppfPMe3	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-5227.4384167; Eh
	30-May-2021	/reaction_profiles/PC6H4F3 NidppfPC6H4F3+rad_oss	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8984.2045099; Eh
	30-May-2021	/reaction_profiles/PC6H4F3 NidppfPC6H4F3+rad_trip	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8984.2044976; Eh
	30-May-2021	/reaction_profiles/PMe3 NidppfPMe3_HATS_triplet	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8111.5380706; Eh
	30-May-2021	/reaction_profiles/PMe3 NidppfPMe3_HATS_oss	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8111.5560644; Eh

Results 61-70 of 186 (Search time: 0.002 seconds).