Search
Add filters:
Use filters to refine the search results.
- previous
- 1
- next
Item hits:
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 3-May-2019 | bp86-Co-16-OH-III | Craig, Michael | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | RBP86 | lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d) | -1765.15919353; Eh | |||
 | 3-May-2019 | bp86-Ru-2-H2O-II | Craig, Michael | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | RBP86 | lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d) | -1877.87350192; Eh | |||
 | 3-May-2019 | bp86-Ru-9-OOHREDOXED | Craig, Michael | Gaussian; 09; ES64L-G09RevE.01 | Geometry optimization Minimum | RBP86 | lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d) | -2059.31048657; Eh |
Results 1-3 of 3 (Search time: 0.001 seconds).
Discover
Program name
- 3 Gaussian