Structure

Basic information

Pretty formulaVO2
Full formulaV2O4
Tags
Constituent elementsO; V;
Number of elements2
Number of sites6
Volume74.01733 Å3
Density3.72144 g/cm3
Source Materials Project

Space group

Spacegroup Number12
Hermann MauguinC2/m
Hall-C 2y
Crystal SystemMonoclinic

Lattice Parameters

a2.943 Å b5.127 Å c5.243 Å
α99.759° β92.756° γ71.731°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-45.78261 eV -7.63044 eV -2.34303 eV 1.06770 eV 0.00000 eV 0.14460 eV