Detail information of Na2ZnP(H5O4)3

Structure

Basic information

Pretty formulaNa2ZnP(H5O4)3
Full formulaNa8Zn4P4H60O48
TagsDisodium zinc phosphate hydroxide heptahydrate
Constituent elementsH; Na; O; P; Zn;
Number of elements5
Number of sites124
Volume1,140.77739 Å3
Density2.03481 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a6.465 Å b21.624 Å c8.666 Å
α90.000° β109.685° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-640.87730 eV -5.16837 eV -1.66198 eV 4.16540 eV 0.00840 eV 0.01920 eV