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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 20-Feb-2023 | PT5_low_26 | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.7985946; Eh | |||
| 20-Feb-2023 | PT5_low_27 | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.8000364; Eh | |||
| 20-Feb-2023 | PT5_low_29 | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.8017636; Eh | |||
| 20-Feb-2023 | PT5_low_33 | Curti, Mariano | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.8143186; Eh | |||
| 20-Feb-2023 | PT5_low_30 | Curti, Mariano | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.8147513; Eh | |||
| 20-Feb-2023 | PT5_low_28 | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.7976379; Eh | |||
| 20-Feb-2023 | PT5_low_32 | Curti, Mariano | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.7958818; Eh | |||
| 20-Feb-2023 | PT5_low_25 | Curti, Mariano | Gaussian; 16; ES64L-G16RevB.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.7987782; Eh | |||
| 20-Feb-2023 | PT5_low_31 | Curti, Mariano | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.8012135; Eh | |||
| 20-Feb-2023 | PT5_high_15 | Curti, Mariano | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RCAM-B3LYP; TD-FC | 6-31G(D) | -2692.7896264; Eh |
Results 201-210 of 273 (Search time: 0.001 seconds).