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_anion_second_TS125 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.722445500578; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS126 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.727266352766; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS127 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.722059032922; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS120 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.720864770987; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS121 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.722443225421; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS123 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.729201803257; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS122 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.722503533683; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS119 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.721290912755; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS186 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.726949234771; Eh | - | - | |
| 6-Mar-2026 | aldol_anion_second_TS188 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -738.728415335209; Eh | - | - |
Results 390001-390010 of 402373 (Search time: 0.236 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 >