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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 6-Mar-2026 | aldol_diffsub_initial_TS365_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.606907246108; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS367_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.597775088737; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS381_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.604273016688; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS391_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.591823943643; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS396_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.609075832663; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS398_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.602801259671; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS471_1 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.597829028803; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS484_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.603799766721; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS485_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.606243910673; Eh | - | - | |
| 6-Mar-2026 | aldol_diffsub_initial_TS488_0 | Matsutani, Satoshi | GRRM; 23 | Saddle | wB97XD | def2svpp | -774.600925577832; Eh | - | - |
Results 389381-389390 of 402284 (Search time: 0.209 seconds).
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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
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