Detail information of Mg2P2H12O13

Structure

Basic information

Pretty formulaMg2P2H12O13
Full formulaMg8P8H48O52
TagsDimagnesium diphosphate hexahydrate
Constituent elementsH; Mg; O; P;
Number of elements4
Number of sites116
Volume1,031.33761 Å3
Density2.12946 g/cm3
Source Materials Project

Space group

Spacegroup Number14
Hermann MauguinP21/c
Hall-P 2ybc
Crystal SystemMonoclinic

Lattice Parameters

a7.279 Å b18.442 Å c7.691 Å
α90.000° β92.663° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-662.94993 eV -5.71509 eV -1.99417 eV 5.07380 eV 0.00000 eV 0.00645 eV