Structure

Basic information

Pretty formulaMoO3
Full formulaMo4O12
Tags
Constituent elementsMo; O;
Number of elements2
Number of sites16
Volume244.31544 Å3
Density3.91322 g/cm3
Source Materials Project

Space group

Spacegroup Number7
Hermann MauguinPc
HallP -2yc
Crystal SystemMonoclinic

Lattice Parameters

a5.204 Å b5.321 Å c9.190 Å
α73.781° β90.000° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-111.54115 eV -6.97132 eV -1.96357 eV 0.50500 eV 0.00000 eV 0.05991 eV