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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 27-Jul-2021 | Nb04O12_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -5.59811846; Eh | |||
| 27-Jul-2021 | Nb10O28_2H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -13.10047714; Eh | |||
| 27-Jul-2021 | Nb5O16_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -7.52311255; Eh | |||
| 27-Jul-2021 | Nb6O19_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -8.95366299; Eh | |||
| 27-Jul-2021 | Nb5O16_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -7.44426849; Eh | |||
| 27-Jul-2021 | Nb6O19_2H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -8.99111772; Eh | |||
| 27-Jul-2021 | Nb7O22_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -10.27523790; Eh | |||
| 27-Jul-2021 | V9O27_2H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -11.96987978; Eh | |||
| 27-Jul-2021 | V8O24_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -10.63347936; Eh | |||
| 27-Jul-2021 | V9O27_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -11.95931517; Eh |
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- 373 Niobium
- 373 Polyoxometalates
- 373 Vanadium