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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 28-May-2019 | /M5O18_2H M5O18_2H | Petrus, Enric | ADF; 2016 | Geometry optimization | DFT | TZP | - | |||
| 28-May-2019 | /M1O4_1H M1O4_1H | Petrus, Enric | ADF; 2016 | Geometry optimization | DFT | TZP | - | |||
| 28-May-2019 | /M2O7_0H M2O7_0H | Petrus, Enric | ADF; 2016 | Geometry optimization | DFT | TZP | - | |||
| 28-May-2019 | /M6O21_3H M6O21_3H | Petrus, Enric | ADF; 2016 | Geometry optimization | DFT | TZP | - | |||
| 28-May-2019 | /M5O18_3H M5O18_3H | Petrus, Enric | ADF; 2016 | Geometry optimization | DFT | TZP | - | |||
| 28-May-2019 | /M2O7_1H M2O7_1H | Petrus, Enric | ADF; 2016 | Geometry optimization | DFT | TZP | - | |||
| 28-May-2019 | /M6O21_2H M6O21_2H | Petrus, Enric | ADF; 2016 | Geometry optimization | DFT | TZP | - | |||
| 28-May-2019 | /M2O7_2H_2iso M2O7_2H_2iso | Petrus, Enric | ADF; 2016 | Geometry optimization | DFT | TZP | - | |||
 | 21-Jun-2019 | /U_Nb/isodesmic_pair/NbOOH NbOOH | Petrus, Enric | ADF; 2016 | Geometry optimization | BP86 | TZP | - | |||
 | 21-Jun-2019 | /U_Nb/isodesmic_pair/UO2 UO2 | Petrus, Enric | ADF; 2016 | Geometry optimization | BP86 | TZP | - |
Results 21-30 of 852 (Search time: 0.001 seconds).