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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
29-Mar-2017 | fragsTa | Serapian, Stefano | ADF; 2016 | Single point | DFT | - | - | ||||
10-May-2016 | /empty_capsules_single_point C60_AASB | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - | ||||
10-May-2016 | /empty_capsules_single_point C60_ABSA | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - | ||||
10-May-2016 | /empty_capsules_single_point C60_SASA | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - | ||||
10-May-2016 | /empty_capsules_single_point C60_ABAB | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - | ||||
10-May-2016 | /empty_capsules_single_point C70_AAAA | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - | ||||
10-May-2016 | /empty_capsules_single_point C70_AASA | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - | ||||
10-May-2016 | /empty_capsules_single_point C70_AASB | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - | ||||
10-May-2016 | /empty_capsules_single_point C70_ABAB | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - | ||||
10-May-2016 | /empty_capsules_single_point C60_SBSB | Serapian, Stefano | ADF; 2013; 01 | Single point | DFT | TZP | - |
Results 31-40 of 158 (Search time: 0.001 seconds).