Structure

Basic information

Pretty formulaH2CS3
Full formulaH32C16S48
TagsTrithiocarbonic acid - alpha
Constituent elementsC; H; S;
Number of elements3
Number of sites96
Volume1,928.36909 Å3
Density1.51861 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a6.062 Å b23.217 Å c13.707 Å
α90.000° β91.697° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-444.48448 eV -4.63005 eV -0.28035 eV 2.01810 eV 0.00729 eV 0.18637 eV