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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 14-Jul-2015 | Adsorption_of_ClC6H4NH2_on_Lindlar | Almora, Neyvis | vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex | Geometry optimization | - | - | -527.62904970; eV | |||
 | 14-Jul-2015 | Adsorption_of_ClC6H4NO2_on_Lindlar | Almora, Neyvis | vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex | Geometry optimization | - | - | -530.38511769; eV | |||
 | 14-Jul-2015 | Adsorption_of_ClC6H4NH2_on_Pt(111) | Almora, Neyvis | vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex | Geometry optimization | - | - | -532.51116317; eV | |||
 | 14-Jul-2015 | Adsorption_of_ClC6H4NH2_on_c-Pt | Almora, Neyvis | vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex | Geometry optimization | - | - | -1724.16014645; eV | |||
 | 14-Jul-2015 | Adsorption_of_ClC6H4NO2_on_c-Pt | Almora, Neyvis | vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex | Geometry optimization | - | - | -1725.31315030; eV | |||
 | 14-Jul-2015 | Adsorption_of_ClC6H4NO2_on_Pt(111) | Almora, Neyvis | vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex | Geometry optimization | - | - | -534.52984167; eV |
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