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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 27-Sep-2021 | SCO_B3LYP_S10_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -2719.13106035; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S8_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -2791.18183607; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S10_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -2719.13203843; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S6_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -3114.14138391; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S5_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -2709.01959956; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S6_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Minimum | UB3LYP | DEF2TZVP | -3114.14175826; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S4_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -2719.14748920; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S4_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -2719.14867613; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S3_LS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -2866.40794978; Eh | |||
| 27-Sep-2021 | SCO_B3LYP_S3_HS | Vidal, Daniel | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | UB3LYP | DEF2TZVP | -2866.40564562; Eh |
Results 21-30 of 38 (Search time: 0.002 seconds).