Structure

Basic information

Pretty formulaK3Mo4H6O16F
Full formulaK6Mo8H12O32F2
TagsHexapotassium difluorooctamolybdate hexahydrate
Constituent elementsF; H; K; Mo; O;
Number of elements5
Number of sites60
Volume842.66591 Å3
Density3.08234 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a10.719 Å b10.604 Å c8.124 Å
α106.429° β96.597° γ103.987°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-359.60092 eV -5.99335 eV -1.95293 eV 0.00650 eV 0.00000 eV 0.03354 eV