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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-15 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01589584; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-07 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01592469; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-17 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01663221; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-13 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01593025; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-30 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01475512; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-47 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01329146; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-23 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01302709; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-24 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01569665; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-25 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01572340; Eh | |||
| 18-Jan-2024 | /C418-2 C418_2-opt-freq-conf-48 | Ross, Alicia | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | RB3LYP | 6-31+G(D,P) | -1379.01652507; Eh |
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