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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 27-Jul-2021 | Ta24O72_9H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -34.38147836; Eh | |||
| 27-Jul-2021 | Ta10O28_2H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -13.24359822; Eh | |||
| 27-Jul-2021 | Ta8O25_4H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -11.95911228; Eh | |||
| 27-Jul-2021 | Ta8O25_5H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -11.95701536; Eh | |||
| 27-Jul-2021 | Ta6O19_2H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -9.10238155; Eh | |||
| 27-Jul-2021 | Ta10O28_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -13.27735671; Eh | |||
| 27-Jul-2021 | Ta10O28_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -13.29731154; Eh | |||
| 27-Jul-2021 | Ta7O22_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -10.44680634; Eh | |||
| 27-Jul-2021 | Ta04O12_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -5.64185413; Eh | |||
| 27-Jul-2021 | Ta04O12_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -5.63759485; Eh |
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- 373 Niobium
- 373 Polyoxometalates
- 373 Vanadium