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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 16-Jan-2023 | ts-67-t | Kiriakidi, Sofia | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | UB3PW91 | DEF2SVP | -1576.22590543; Eh | |||
 | 16-Jan-2023 | ts-67-IRC | Kiriakidi, Sofia | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | - | DEF2SVP | -1576.22309893; Eh | |||
 | 16-Jan-2023 | ts-45-IRC | Kiriakidi, Sofia | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | - | DEF2SVP | -1525.86093206; Eh |
Results 121-123 of 123 (Search time: 0.002 seconds).