Detail information of MoPH3O7

Structure

Basic information

Pretty formulaMoPH3O7
Full formulaMo2P2H6O14
TagsMolybdate(VI) deuterophosphate(V) dideuterium oxide
Constituent elementsH; Mo; O; P;
Number of elements4
Number of sites24
Volume290.95630 Å3
Density2.76151 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a6.830 Å b6.429 Å c7.045 Å
α90.000° β109.850° γ90.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-151.60303 eV -6.31679 eV -1.97610 eV 3.18570 eV 0.00000 eV 0.00004 eV