Search
Add filters:
Use filters to refine the search results.
Item hits:
Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
1-Apr-2023 | co-pc-Py_CO2_+1_3_pcm_f_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3486.09139250; Eh | ||||
1-Apr-2023 | co-pc-Py_CO_+2_2_pcm_f_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3410.59908474; Eh | ||||
1-Apr-2023 | co-pc-Py_+2_2_pcm_f_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3297.29090705; Eh | ||||
1-Apr-2023 | co-pc_+2_2_pcm_nbo_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3049.0702474; Eh | ||||
1-Apr-2023 | co-pc-Im_CO2_+1_3_pcm_nbo_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3464.0602346; Eh | ||||
1-Apr-2023 | co-pc-Py_CO2_+1_3_pcm_nbo_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3486.0913925; Eh | ||||
1-Apr-2023 | co-pc-Py_CO_+2_2_pcm_nbo_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3410.5729797; Eh | ||||
1-Apr-2023 | co-pc-Im_CO_+2_2_pcm_nbo_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3388.5893877; Eh | ||||
1-Apr-2023 | co-pc_CO_+2_2_pcm_nbo_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3162.3827026; Eh | ||||
1-Apr-2023 | co-pc-Py_+2_2_pcm_nbo_m6_pc2 | Cooksy, Andrew | Gaussian; 16; EM64L-G16RevB.01 | Single point Structure | UM06 | GEN | -3297.2650078; Eh |
Results 11-20 of 21 (Search time: 0.001 seconds).
Discover
Program name
- 21 Gaussian
Calculation type