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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 2-Jul-2018 | /Vacancy_alpha/Vacancy_alpha Vacancy_diffusion_in_alpha-Ni(OH)2 | Elbaz, Yuval | vasp; 5.3.3; 18Dez12 (build Jan 06 2015 13:04:21) complex | Geometry optimization | PBE+U | - | -98.22908164; eV | |||
 | 2-Jul-2018 | /Interstitial_NiOH2 Interstitial_diffusion_in_NiOH2 | Elbaz, Yuval | vasp; 5.4.1; 05Feb16 (build Jul 27 2017 14:58:18) complex | Geometry optimization | PBE+U | - | -200.63653600; eV | |||
 | 2-Jul-2018 | /Interstitial_NiOOH Interstitial_diffusion_in_NiOOH | Elbaz, Yuval | vasp; 5.3.3; 18Dez12 (build Sep 16 2013 14:52:01) complex | Geometry optimization | PBE+U | - | -241.85460017; eV | |||
 | 2-Jul-2018 | /Vacancy_NiOH2 Vacancy_diffusion_in_b-NiOH2 | Elbaz, Yuval | vasp; 5.3.3; 18Dez12 (build Sep 16 2013 14:52:01) complex | Geometry optimization | PBE+U | - | -194.33978439; eV | |||
 | 2-Jul-2018 | /Vacancy_NiOOH Vacancy_diffusion_in_NiOOH | Elbaz, Yuval | vasp; 5.3.3; 18Dez12 (build Sep 16 2013 14:52:01) complex | Geometry optimization | PBE+U | - | -232.27688712; eV |
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