Detail information of NaZnP2HClO7

Structure

Basic information

Pretty formulaNaZnP2HClO7
Full formulaNa8Zn8P16H8Cl8O56
TagsDisodium zinc diphosphate(V) - hydrogen chloride (1/1)
Constituent elementsCl; H; Na; O; P; Zn;
Number of elements6
Number of sites104
Volume1,453.98202 Å3
Density2.73002 g/cm3
Source Materials Project

Space group

Spacegroup Number92
Hermann MauguinP41212
HallP 4abw 2nw
Crystal SystemTetragonal

Lattice Parameters

a8.020 Å b8.020 Å c22.606 Å
α90.000° β90.000° γ90.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-594.15952 eV -5.71307 eV -2.05756 eV 3.71140 eV 7.14881 eV 0.21424 eV