Structure

Basic information

Pretty formulaZnGaP2H4NO8
Full formulaZn4Ga4P8H16N4O32
Tags
Constituent elementsGa; H; N; O; P; Zn;
Number of elements6
Number of sites68
Volume810.26933 Å3
Density2.81266 g/cm3
Source Materials Project

Space group

Spacegroup Number1
Hermann MauguinP1
HallP 1
Crystal SystemTriclinic

Lattice Parameters

a9.163 Å b9.478 Å c9.486 Å
α89.098° β82.263° γ83.073°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-415.93100 eV -6.11663 eV -2.00542 eV 3.58020 eV 0.00000 eV 0.00770 eV