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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
1-Sep-2023 | MK_RS7_Val | Novotny, Jan | Gaussian; 09; EM64L-G09RevC.01 | Single point Structure | RM062X | GEN | -645.9590845; Eh | ||||
1-Sep-2023 | MK_RS8_Val | Novotny, Jan | Gaussian; 09; EM64L-G09RevC.01 | Single point Structure | RM062X | GEN | -645.945571; Eh | ||||
1-Sep-2023 | MK_RS8 | Novotny, Jan | Gaussian; 09; EM64L-G09RevC.01 | Single point Structure | RM062X | GEN | -645.9730125; Eh | ||||
1-Sep-2023 | MK_RS7 | Novotny, Jan | Gaussian; 09; EM64L-G09RevC.01 | Single point Structure | RM062X | GEN | -645.9717552; Eh |
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