Search
Add filters:
Use filters to refine the search results.
Item hits:
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 30-May-2021 | /reaction_profiles/AsPh3 NidppfAsPh32 | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -10627.1496902; Eh | |||
 | 30-May-2021 | /reaction_profiles/PC6H4OMe3 NidppfPC6H4OMe3BrR | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -9029.9752308; Eh | |||
 | 30-May-2021 | /reaction_profiles/POPh3 NidppfPOPh3BrR | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -8912.1958048; Eh | |||
 | 30-May-2021 | /reaction_profiles/POPh3 NidppfPOPh3 | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -6028.0483622; Eh | |||
 | 30-May-2021 | /reaction_profiles/NMe3 NMe3 | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -174.3859669; Eh | |||
 | 30-May-2021 | /reaction_profiles/AsPh3 NidppfAsPh3 | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -7696.7642773; Eh | |||
 | 30-May-2021 | /reaction_profiles/AsPh3 AsPh3 | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -2930.342451; Eh | |||
 | 30-May-2021 | /reaction_profiles/AsPh3 NidppfAsPh3BrR | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -10580.9038277; Eh | |||
 | 30-May-2021 | /reaction_profiles/SbPh3 NidppfSbPh32 | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -6166.3781494; Eh | |||
 | 30-May-2021 | /reaction_profiles/PC6H4OMe3 NidppfPC6H4OMe32 | Nelson, David | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM06 | 6-311+G(D,P) GENECP | -7525.2598034; Eh |
Results 41-50 of 69 (Search time: 0.002 seconds).