Detail information of Fe5P4(H3O10)2

Structure

Basic information

Pretty formulaFe5P4(H3O10)2
Full formulaFe10P8H12O40
TagsPentairon decahydride tetraphosphorus icosaoxide
Constituent elementsFe; H; O; P;
Number of elements4
Number of sites70
Volume722.81176 Å3
Density3.35023 g/cm3
Source Materials Project

Space group

Spacegroup Number15
Hermann MauguinC2/c
Hall-C 2yc
Crystal SystemMonoclinic

Lattice Parameters

a9.915 Å b9.915 Å c9.247 Å
α83.988° β96.012° γ126.818°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-454.16270 eV -6.48804 eV -2.07764 eV 1.44310 eV 48.00000 eV 0.06241 eV