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): 2861 to 2880 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_1791 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.07887239; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1792 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.44928879; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1793 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.92365837; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1794 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.54169000; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1795 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -425.54578307; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1796 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.73408739; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1797 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.03381597; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1798 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -427.91502215; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1799 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.41545263; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_18 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -426.99278012; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_180 | Song, Haohong | vasp; 6.3.2; 27Jun22 (build Feb 11 2023 09:31:23) complex | Single point | DFT | - | -426.08314486; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1800 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -425.53698989; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1801 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -428.23784999; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1802 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.47009963; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1803 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.83903933; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1804 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.65772132; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1805 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -425.78787310; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1806 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -427.25850747; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1807 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -426.05315682; eV | |||
 | 9-Apr-2025 | /H_surface H_surface_1808 | Song, Haohong | vasp; 6.4.1; 05Apr23 (build May 18 2023 13:19:41) complex | Single point | DFT | - | -427.36881732; eV |
Collection's Items (Sorted by Submit Date in Descending order): 2861 to 2880 of 4380
