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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 9-Nov-2022 | /enamine/toluene INT2c_toluene | Guo, Wentao | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RM062X | 6-31G(D) | -1885.61653082; Eh | |||
 | 15-Jan-2019 | i101 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - | |||
 | 15-Jan-2019 | i95 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - | |||
 | 15-Jan-2019 | i94 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - | |||
 | 15-Jan-2019 | i83 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - | |||
 | 15-Jan-2019 | i78 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - | |||
 | 15-Jan-2019 | i66 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - | |||
 | 21-Jan-2019 | i59_2 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - | |||
 | 15-Jan-2019 | i42 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - | |||
 | 15-Jan-2019 | i34 | Galvao, Tiago | Gaussian; 09; ES64L-G09RevD.01 | Single point Structure | RM062X | - | - |
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- 6 TD-FC