Detail information of KSn2H36C12(Se2N)3

Structure

Basic information

Pretty formulaKSn2H36C12(Se2N)3
Full formulaK2Sn4H72C24Se12N6
TagsTris(tetramethylammonium) potassium hexaselenidodistannate
Constituent elementsC; H; K; N; Se; Sn;
Number of elements6
Number of sites120
Volume1,547.13765 Å3
Density2.08802 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a9.785 Å b10.218 Å c16.297 Å
α95.165° β92.660° γ107.026°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-599.02746 eV -4.99190 eV -0.30442 eV 1.88870 eV 0.03097 eV 0.03782 eV