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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Jul-2020 | Mo1O4_0H_PBE0 | Petrus, Enric | ADF; 2019 | Frequencies | PBE0 == Not Default == | TZP | - | |||
 | 24-Jul-2020 | 2H2O_PBE0 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE0 == Not Default == | TZP | -1.36240350; Eh | |||
 | 24-Jul-2020 | Mo1O4_2H_PBE0 | Petrus, Enric | ADF; 2019 | Frequencies | PBE0 == Not Default == | TZP | - | |||
 | 24-Jul-2020 | Mo1O4_1H_PBE0 | Petrus, Enric | ADF; 2019 | Frequencies | PBE0 == Not Default == | TZP | - | |||
 | 24-Jul-2020 | Mo2O7_1H_PBE0 | Petrus, Enric | ADF; 2019 | Frequencies | PBE0 == Not Default == | TZP | - | |||
 | 24-Jul-2020 | Mo2O7_0H_PBE0 | Petrus, Enric | ADF; 2019 | Frequencies | PBE0 == Not Default == | TZP | - | |||
 | 24-Jul-2020 | H2O_PBE0 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE0 == Not Default == | TZP | -0.67830722; Eh | |||
 | 24-Jul-2020 | Mo2O7_2H_PBE0 | Petrus, Enric | ADF; 2019 | Frequencies | PBE0 == Not Default == | TZP | - | |||
 | 24-Jul-2020 | H3O_PBE0 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE0 == Not Default == | TZP | -0.64727072; Eh | |||
 | 24-Jul-2020 | Mo3O10_0H_PBE0 | Petrus, Enric | ADF; 2019 | Frequencies | PBE0 == Not Default == | TZP | - |
Results 21-30 of 34 (Search time: 0.001 seconds).