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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 26-Mar-2018 | C4 | Ortuño, Manuel | vasp; 5.3.5; 31Mar14 (build Jul 4 2017 09:52:38) complex | Frequencies | PBE | - | -1111.24814808; eV | |||
 | 24-Jul-2020 | H2Mo6O20 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 24-Jul-2020 | Mo7O24 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 26-Mar-2018 | C3 | Ortuño, Manuel | vasp; 5.3.5; 31Mar14 (build Jul 4 2017 09:52:38) complex | Frequencies | PBE | - | -1110.84680538; eV | |||
 | 24-Jul-2020 | HMo8O26 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 24-Jul-2020 | H5O2 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 24-Jul-2020 | Mo_2OH_2H2O_watercluster | Petrus, Enric | ADF; 2019 | Single point | PBE | TZP | - | |||
 | 24-Jul-2020 | Mo_2OH_2H2O | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 24-Jul-2020 | Mo4O13 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 24-Jul-2020 | HMoO4 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - |
Results 21-30 of 1546 (Search time: 0.002 seconds).