Structure

Basic information

Pretty formulaLi10Ge(PSe6)2
Full formulaLi20Ge2P4Se24
Tags
Constituent elementsGe; Li; P; Se;
Number of elements4
Number of sites50
Volume1,164.28892 Å3
Density3.28465 g/cm3
Source Materials Project

Space group

Spacegroup Number1
Hermann MauguinP1
HallP 1
Crystal SystemTriclinic

Lattice Parameters

a9.053 Å b9.400 Å c13.691 Å
α91.929° β90.690° γ90.318°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-194.05701 eV -3.88114 eV -0.82531 eV 1.31310 eV 0.00243 eV 0.00000 eV