MgO

Compound Formula
MgO
Name
Magnesium Oxide
# 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
Published
ID
5fbe74c355b80f74f80d0caa
Data Modified
25/11/2020 15:14:44
Metadata Modified
25/11/2020 15:17:13

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Related Bulk Structures

Status
ThumbnailStatusEnergy (eV)Energy CalculationEnergy Methodk-points
Chemical structure of Magnesium OxideCalculated-7473.573127N/ACrystal - PBE (Tight)[4, 4, 4]
Chemical structure of Magnesium OxideCalculated-7473.584122N/ACrystal - PBE (Tight)[5, 5, 5]
Chemical structure of Magnesium OxideBest Calculated-7473.585915N/ACrystal - PBE (Tight)[6, 6, 6]