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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 19-Mar-2026 | /PMoW P01Mo00W05O19-1H-iso-0 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -8.06851166; Eh | |||
 | 19-Mar-2026 | /PMoW P01Mo04W07O39-3H-iso-25401606 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -16.64239617; Eh | |||
 | 19-Mar-2026 | /PMoW P01Mo01W10O39-3H-iso-36288000 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -16.83043154; Eh | |||
 | 19-Mar-2026 | /PMoW P01Mo04W05O34-3H-iso-2593 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -14.60562127; Eh | |||
 | 19-Mar-2026 | /PMoW P01Mo03W06O34-0H-iso-25212 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -14.55843317; Eh | |||
 | 19-Mar-2026 | /PMoW P01Mo04W05O34-0H-iso-2532 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -14.49444107; Eh | |||
 | 19-Mar-2026 | /PMoW P00Mo01W02O11-2H-iso-0 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -4.84467268; Eh | |||
 | 19-Mar-2026 | /PMoW P01Mo01W02O13-2H-iso-0 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -5.43664409; Eh | |||
 | 19-Mar-2026 | /PMoW P00Mo02W01O10-0H-iso-3 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -4.24033416; Eh | |||
 | 19-Mar-2026 | /PMoW P00Mo01W01O07-0H-iso-0 | Buils, Jordi | ADF; 2019 | Geometry optimization | PBE | TZP | -3.03268174; Eh |
Results 104221-104230 of 104297 (Search time: 0.067 seconds).
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Subject
- 13599 Heterogeneous catalysis
- 12448 Adsorption
- 12178 Transition metals
- 7049 Transition states
- 4273 Supramolecular chemistry
- 4255 Nanostructures
- 4250 Electrochemical CO₂ reduction
- 4232 Conformation analysis
- 4232 N-Oxides
- 3932 Copper
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