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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Oct-2023 | 1oxy,_dir_Ag20_GCN_3_14 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only | Geometry optimization | DFT | - | -47.83606396; eV | |||
 | 24-Oct-2023 | 1oxy,_dir_Ag20_GCN_2_73 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only | Geometry optimization | DFT | - | -46.60177120; eV | |||
 | 24-Oct-2023 | 1oxy,_dir_Ag20_GCN_3_67 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only | Geometry optimization | DFT | - | -47.83518509; eV | |||
 | 24-Oct-2023 | O2,_dir_Ag20_abs2_edges | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only | Geometry optimization | DFT | - | -51.98596803; eV | |||
 | 24-Oct-2023 | O2,_dir_Ag20_abs10 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only | Geometry optimization | DFT | - | -52.15806663; eV | |||
 | 24-Oct-2023 | O2,_dir_Ag20_abs1 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only | Geometry optimization | DFT | - | -52.03473626; eV | |||
 | 24-Oct-2023 | O2,_dir_Ag20_abs3 | Bruix, Albert | vasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-only | Geometry optimization | DFT | - | -52.03964306; eV |
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- 67 AgO
- 67 DFT
- 67 oxygen adsorption
- 34 metal nanoparticles
- 34 Nanoparticles
- 34 oxidized metals
- 34 silver
- 33 nanoparticles
- 33 oxidation
- 33 Silver
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- 67 DFT