MgO

Compound Formula
MgO
Name
Magnesium Oxide
# Atoms
8
Stoichiometry
1:1
Unit Cell
a
4.2315
b
4.2315
c
4.2315
alpha
90.0
beta
90.0
gamma
90.0
Space Group
225 (F m -3 m)
Energy (eV)
-7473.585915
Energy Method
Crystal - PBE (Tight)
k-points
[6, 6, 6]
Status
Best Calculated
ID
5fbe757955b80f74f80d0cb9
Data Modified
25/11/2020 15:22:26
Metadata Modified
25/11/2020 15:22:37

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Related Bulk Structures

Status
ThumbnailStatusEnergy (eV)Energy Methodk-points
Chemical structure of Magnesium OxidePublished
Chemical structure of Magnesium OxideCalculated-7473.573127Crystal - PBE (Tight)[4, 4, 4]
Chemical structure of Magnesium OxideCalculated-7473.584122Crystal - PBE (Tight)[5, 5, 5]