Detail information of Zn2PHO5

Structure

Basic information

Pretty formulaZn2PHO5
Full formulaZn4P2H2O10
TagsDizinc phosphate(V) hydroxide;
Tarbuttite
Constituent elementsH; O; P; Zn;
Number of elements4
Number of sites18
Volume203.27777 Å3
Density3.96672 g/cm3
Source Materials Project

Space group

Spacegroup Number2
Hermann MauguinP-1
Hall-P 1
Crystal SystemTriclinic

Lattice Parameters

a5.611 Å b5.758 Å c6.586 Å
α102.070° β102.333° γ87.343°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-103.48678 eV -5.74927 eV -2.15422 eV 3.23510 eV 0.00000 eV 0.00159 eV