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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 28-Jul-2021 | Ta16O49_8H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -23.44503041; Eh | |||
| 28-Jul-2021 | Ta5O16_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -7.59990156; Eh | |||
| 28-Jul-2021 | Ta4O13_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -6.18211744; Eh | |||
| 28-Jul-2021 | Ta5O16_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -7.52447456; Eh | |||
| 28-Jul-2021 | Ta4O13_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -6.13509241; Eh | |||
| 28-Jul-2021 | Ta24O72_10H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -34.38547138; Eh | |||
| 28-Jul-2021 | Ta4O12_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -5.64185413; Eh | |||
| 28-Jul-2021 | Ta3O10_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -4.72458468; Eh | |||
| 28-Jul-2021 | Ta4O12_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -5.63759485; Eh | |||
| 28-Jul-2021 | Ta3O10_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -4.69913794; Eh |
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