Detail information of Li3N

Structure

Basic information

Pretty formulaLi3N
Full formulaLi6N2
TagsLithium nitride - beta;
Trilithium nitride - beta
Constituent elementsLi; N;
Number of elements2
Number of sites8
Volume69.86152 Å3
Density1.65574 g/cm3
Source Materials Project

Space group

Spacegroup Number194
Hermann MauguinP63/mmc
Hall-P 6c 2c
Crystal SystemHexagonal

Lattice Parameters

a3.565 Å b3.565 Å c6.349 Å
α90.000° β90.000° γ120.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-30.96061 eV -3.87008 eV -0.45032 eV 1.21800 eV 0.00000 eV 0.00967 eV