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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/PCy3 NiBrdppfPCy3+rad_recomb_sqbp_t	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8697.3246348; Eh
	30-May-2021	/reaction_profiles/PCy3 NiBrdppfPCy3+rad_oss	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8697.3543391; Eh
	30-May-2021	/reaction_profiles/PCy3 NiBrdppfPCy3+rad_triplet	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8697.3543088; Eh
	30-May-2021	/reaction_profiles/PCy3 NidppfPCy3_HATS_oss	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8697.3298111; Eh
	30-May-2021	/reaction_profiles/PMe3 NiBrRdppfPMe3_tbp	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-8111.5811798; Eh
	30-May-2021	/reaction_profiles/NMe3 NidppfNMe3_HATS_oss	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-7824.907519; Eh
	30-May-2021	/reaction_profiles/POPh3 NidppfPOPh3_HATS_triplet	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8912.1461356; Eh
	30-May-2021	/reaction_profiles/NMe3 NidppfNMe3	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-4940.7838421; Eh
	30-May-2021	/reaction_profiles/POPh3 NidppfPOPh3_HATS_oss	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	UM06	6-311+G(D,P) GENECP	-8912.1586173; Eh
	30-May-2021	/reaction_profiles/POPh3 NidppfPOPh32	Nelson, David	Gaussian; 16; AM64L-G16RevA.03	Single point Structure	RM06	6-311+G(D,P) GENECP	-7289.7167518; Eh

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