Detail information of KB3(H3O4)2

Structure

Basic information

Pretty formulaKB3(H3O4)2
Full formulaK4B12H24O32
TagsPotassium triborate(III) trihydrate
Constituent elementsB; H; K; O;
Number of elements4
Number of sites72
Volume933.32718 Å3
Density1.46300 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a9.658 Å b9.658 Å c17.006 Å
α73.705° β106.295° γ141.968°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-416.08136 eV -5.77891 eV -1.64342 eV 4.00190 eV 0.00000 eV 0.46969 eV