Detail information of CsVH24(SO10)2

Structure

Basic information

Pretty formulaCsVH24(SO10)2
Full formulaCs4V4H96S8O80
TagsCesium vanadium(III) bis(sulfate(VI)) dodecahydrate;
Cesium vanadium(III) bis(sulfate(VI)) dodecakis
Constituent elementsCs; H; O; S; V;
Number of elements5
Number of sites192
Volume1,964.79886 Å3
Density2.00183 g/cm3
Source Materials Project

Space group

Spacegroup Number205
Hermann MauguinPa-3
Hall-P 2ac 2ab 3
Crystal SystemCubic

Lattice Parameters

a12.525 Å b12.525 Å c12.525 Å
α90.000° β90.000° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-1,021.16648 eV -5.31858 eV -1.59096 eV 2.68920 eV 8.00005 eV 0.00425 eV