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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
9-Jun-2017 | /Tetrahedral tetra04 | Swart, Marcel | ADF; | Single point Quild | DFT | TZ2P | - | ||||
9-Jun-2017 | /Triangle triangle10 | Swart, Marcel | ADF; | Single point Quild | DFT | TZ2P | - | ||||
9-Jun-2017 | /Linear linear10 | Swart, Marcel | ADF; | Single point Quild | DFT | TZ2P | - | ||||
9-Jun-2017 | /Lv3 Lv3 | Swart, Marcel | ADF; 2017 | Geometry optimization | DFT | TZ2P | - | ||||
9-Jun-2017 | /Atoms Co1 | Swart, Marcel | ADF; | Single point | DFT | TZ2P | - | ||||
9-Jun-2017 | /Atoms V3 | Swart, Marcel | ADF; | Single point | DFT | TZ2P | - | ||||
9-Jun-2017 | /Tetrahedral tetra14 | Swart, Marcel | ADF; | Single point Quild | DFT | TZ2P | - | ||||
9-Jun-2017 | /Atoms Fe4 | Swart, Marcel | ADF; | Single point | DFT | TZ2P | - | ||||
9-Jun-2017 | /Tetrahedral tetra06 | Swart, Marcel | ADF; | Single point Quild | DFT | TZ2P | - | ||||
9-Jun-2017 | /Atoms V1 | Swart, Marcel | ADF; | Single point | DFT | TZ2P | - |
Results 11-20 of 46 (Search time: 0.001 seconds).