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. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 6-Mar-2026 | aldol_diffsub_second_TS44 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.609045143618; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS45 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.610384127510; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS46 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.608476093915; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS47 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.608540997365; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS157 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.605835700768; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS156 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.603917549506; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS158 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.606392915161; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS159 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.604266483675; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS160 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.603498282151; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_second_TS161 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.601097293404; Eh | - | - |
Results 390041-390050 of 402373 (Search time: 0.24 seconds).
Discover
Subject
- 12577 Density functional calculations
- 6967 Radicals
- 6799 Ab initio calculations
- 6766 Aromaticity
- 6643 Magnetic properties
- 6348 Electric Field
- 6348 Magnetoelectricity
- 4188 2D Covalent Organic Frameworks
- 3761 BF3 Solvation
- 3145 Homogeneous catalysis
- next >