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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 19-Mar-2026 | /Adsorptions/FF FF-Ag-3S | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -273.82554725; eV | |||
| 19-Mar-2026 | /Adsorptions/HF dl-HF-Ag(111) | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -339.51323819; eV | |||
| 19-Mar-2026 | /Adsorptions/FF FF-Ag-1S | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -263.81617053; eV | |||
| 19-Mar-2026 | /Adsorptions/FA FA-Ag(211) | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -327.08063641; eV | |||
| 19-Mar-2026 | /Adsorptions/FF FF-Ag(111) | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -258.85306950; eV | |||
| 19-Mar-2026 | /Energy-profiles/FF-to-HF/FF-to-dl-HF-Ag-4S FFH-FF-Ag-4S(111) | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -354.81098523; eV | |||
| 19-Mar-2026 | /Energy-profiles/FF-to-HF/FF-to-meso-HF-Ag-2S 2FF-Ag-2S(111) | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -341.74072043; eV | |||
| 19-Mar-2026 | /Energy-profiles/FF-to-HF/FF-to-dl-HF-Ag-S FA-Ag-S(111) | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -344.32872399; eV | |||
| 19-Mar-2026 | /Energy-profiles/FF-to-FA/Ag-S-FF-to-FA FFOH-Ag-S(111) | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -270.35828410; eV | |||
| 19-Mar-2026 | /Energy-profiles/FF-to-FA/Ag-S-FF-to-FA 2H-Ag-S(111) | Morales-Vidal, Jordi | vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex | Geometry optimization | DFT | - | -197.80850888; eV |
Results 100621-100630 of 101944 (Search time: 0.057 seconds).
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Subject
- 13581 Heterogeneous catalysis
- 12448 Adsorption
- 12178 Transition metals
- 7049 Transition states
- 4273 Supramolecular chemistry
- 4255 Nanostructures
- 4232 Conformation analysis
- 4232 Electrochemical CO₂ reduction
- 4232 N-Oxides
- 3914 Copper
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