Detail information of Na3GaP2H2O9

Structure

Basic information

Pretty formulaNa3GaP2H2O9
Full formulaNa6Ga2P4H4O18
TagsTrisodium gallium hydroxide hydrogenphosphate(V) phosphate(V)
Constituent elementsGa; H; Na; O; P;
Number of elements5
Number of sites34
Volume400.76044 Å3
Density2.87267 g/cm3
Source Materials Project

Space group

Spacegroup Number12
Hermann MauguinC2/m
Hall-C 2y
Crystal SystemMonoclinic

Lattice Parameters

a8.598 Å b8.598 Å c7.145 Å
α84.030° β95.970° γ130.203°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-206.24016 eV -6.06589 eV -2.39775 eV 3.98870 eV 0.00000 eV 0.00000 eV