Browsing by Author Stanczak, Agnieszka
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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
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4-Mar-2019 | TS2_Ph_wB97XD | Stanczak, Agnieszka | Gaussian; 09; AM64L-G09RevC.01 | Single point Structure | UwB97XD | - | - | ||||
4-Mar-2019 | TS2_TPSSh | Stanczak, Agnieszka | Gaussian; 09; AM64L-G09RevC.01 | Single point Structure | UTPSSh | - | - | ||||
4-Mar-2019 | TS2_wB97XD | Stanczak, Agnieszka | Gaussian; 09; AM64L-G09RevC.01 | Single point Structure | UwB97XD | - | - |