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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 8-Apr-2024 | /figureS1 1I3Z | Mu, Manting | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RwB97XD | 6-31G(D,P) 6-31+G(D,P) GEN | -1618.22935741; Eh | |||
| 8-Apr-2024 | /figureS1 1IZ | Mu, Manting | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | RwB97XD | 6-31G(D,P) 6-31+G(D,P) GEN | -1209.13137257; Eh |
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- 905 Homogeneous catalysis
- 837 Water splitting
- 138 Sodium
- 93 Iron
- 90 Amides
- 86 Cooperative effects
- 86 Metalation
- 80 Heterogeneous catalysis
- 75 Reaction mechanisms
- 41 Cobalt
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