Structure

Basic information

Pretty formulaCoPH6O6F
Full formulaCo2P2H12O12F2
TagsCobalt monofluorophosphate trihydrate
Constituent elementsCo; F; H; O; P;
Number of elements5
Number of sites30
Volume279.64709 Å3
Density2.50523 g/cm3
Source Materials Project

Space group

Spacegroup Number2
Hermann MauguinP-1
Hall-P 1
Crystal SystemTriclinic

Lattice Parameters

a4.853 Å b5.664 Å c10.396 Å
α96.253° β99.588° γ92.042°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-167.71904 eV -5.59064 eV -1.79733 eV 0.00000 eV 6.00000 eV 0.01220 eV