- Compound Formula
- MgO
- Name
- MgO
- # Atoms
- 8
- Stoichiometry
- 1:1
- Unit Cell
- a
- 4.21041
- b
- 4.21041
- c
- 4.21041
- alpha
- 90.0
- beta
- 90.0
- gamma
- 90.0
- Space Group
- 225 (F m -3 m)
- Energy (eV)
- Energy Method
- k-points
- Status
- Temporary (Help)
- ID
- 5f0d8e5b7754670b7df6daba
- Data Modified
- 14/07/2020 10:53:10
- Metadata Modified
- 14/07/2020 10:53:14
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Surfaces
| Thumbnail | Compound Formula | Miller Index | # Layers | Status | Energy (eV) | Energy Method | # Grids | Grid Values | # Atoms |
|---|
 | MgO | (100) | 0, 3 | Best Calculated | -403550.580944 | Crystal - PBE (Tight) | 0 | | 108 |