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. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 8-Sep-2022 | mepronil_CONF80_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55516470; Eh | |||
 | 8-Sep-2022 | mepronil_CONF9_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55170617; Eh | |||
 | 8-Sep-2022 | mepronil_CONF8_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55187437; Eh | |||
 | 8-Sep-2022 | mepronil_CONF32_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55219172; Eh | |||
 | 8-Sep-2022 | mepronil_CONF31_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55212799; Eh | |||
 | 8-Sep-2022 | mepronil_CONF29_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55644826; Eh | |||
 | 8-Sep-2022 | mepronil_CONF33_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55239710; Eh | |||
 | 8-Sep-2022 | mepronil_CONF30_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55643519; Eh | |||
 | 8-Sep-2022 | mepronil_CONF28_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55223176; Eh | |||
 | 8-Sep-2022 | mepronil_CONF34_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -864.55223023; Eh |
Results 1-10 of 51006 (Search time: 0.004 seconds).