Detail information of MoO3

Structure

Basic information

Pretty formulaMoO3
Full formulaMo2O6
TagsMolybdenum oxide - II, HT
Constituent elementsMo; O;
Number of elements2
Number of sites8
Volume107.80213 Å3
Density4.43433 g/cm3
Source Materials Project

Space group

Spacegroup Number11
Hermann MauguinP21/m
Hall-P 2yb
Crystal SystemMonoclinic

Lattice Parameters

a3.764 Å b3.930 Å c7.492 Å
α103.425° β90.000° γ90.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-55.93899 eV -6.99237 eV -1.98462 eV 1.67960 eV 0.00000 eV 0.03886 eV