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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 2-Mar-2021 | /Molybdenum/Mo1O6_8H Mo1O6_8H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 2-Mar-2021 | /Molybdenum/Mo1O4_0H Mo1O4_0H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 2-Mar-2021 | /Water/H4O2 H4O2 | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 2-Mar-2021 | /Tungsten/W10O32_2H W10O32_2H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -13.77792086; Eh | |||
 | 2-Mar-2021 | /Tungsten/W7O24_1H W7O24_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -10.54220033; Eh | |||
 | 2-Mar-2021 | /Tungsten/W3O11_1H W3O11_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | -4.90060731; Eh | |||
 | 2-Mar-2021 | /Molybdenum/Mo6O27_12H Mo6O27_12H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 2-Mar-2021 | /Molybdenum/Mo6O20_2H Mo6O20_2H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 2-Mar-2021 | /Molybdenum/Mo8O26_2H Mo8O26_2H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - | |||
 | 2-Mar-2021 | /Molybdenum/Mo5O17_1H Mo5O17_1H | Petrus, Enric | ADF; 2019 | Geometry optimization | PBE | TZP | - |
Results 11-20 of 124 (Search time: 0.001 seconds).