ioChem-BD Browse module - collection page
Medium-Entropy-Oxides Collection home page
Share - copy and redistribute the material in any medium or format. Adapt - remix, transform, and build upon the material for any purpose, even commercially. The licensor cannot revoke these freedoms as long as you follow the license terms.
Please use this identifier to cite or link to this collection:
DOI: 10.19061/iochem-bd-6-522
No other publication derived
Browse
Collection's Items (Sorted by Submit Date in Descending order): 2841 to 2860 of 4380
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 9-Apr-2025 | /H_surface H_surface_1773 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.92669811; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1774 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -425.85876468; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1775 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -427.87047525; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1776 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -427.03307259; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1777 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -426.89033193; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1778 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -426.77752493; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1779 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -425.47017816; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_178 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -426.04628116; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1780 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.28436586; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1781 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -425.82278719; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1782 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.76690514; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1783 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -427.40760639; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1784 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -428.09875327; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1785 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -425.30161462; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1786 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.59078561; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1787 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.69811808; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1788 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.94719692; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1789 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -425.61955769; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_179 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -426.83527474; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1790 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.39316957; eV |
Collection's Items (Sorted by Submit Date in Descending order): 2841 to 2860 of 4380
