Detail information of KH3(SO4)2

Structure

Basic information

Pretty formulaKH3(SO4)2
Full formulaK4H12S8O32
TagsPotassium hydrogensulfate(VI) dihydrogenulfate(VI)
Constituent elementsH; K; O; S;
Number of elements4
Number of sites56
Volume739.52548 Å3
Density2.10393 g/cm3
Source Materials Project

Space group

Spacegroup Number14
Hermann MauguinP21/c
Hall-P 2ybc
Crystal SystemMonoclinic

Lattice Parameters

a7.727 Å b11.639 Å c8.924 Å
α90.000° β112.869° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-312.92652 eV -5.58797 eV -1.80656 eV 5.59120 eV 0.00000 eV 0.00000 eV