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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
12-Apr-2017 | lsls_KCoFe(CN)6_HSE03-13_dense-Kpoint-mesh | Hegner, Franziska Simone | vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex | Single point | - | - | -551.55810479; eV | ||||
12-Apr-2017 | BiVO4_HSE03-13_dense-Kpoint-mesh | Hegner, Franziska Simone | vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex | Single point | - | - | -212.39589586; eV | ||||
12-Apr-2017 | BiVO4_HSE03-13_gamma-point | Hegner, Franziska Simone | vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex | Single point | - | - | -212.39589586; eV | ||||
12-Apr-2017 | BiVO4_PBEsol_static | Hegner, Franziska Simone | vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex | Single point | - | - | -176.51532195; eV | ||||
12-Apr-2017 | CoFe-PB+H2O_HSE03-13 | Hegner, Franziska Simone | vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex | Single point | - | - | -566.49771681; eV | ||||
12-Apr-2017 | CoFe-PB+H2O_PBEsol_static | Hegner, Franziska Simone | vasp; 5.3.5; 31Mar14 (build Apr 25 2014 16:28:52) complex | Single point | - | - | -486.60201398; eV |
Results 1-6 of 6 (Search time: 0.002 seconds).