Structure

Basic information

Pretty formulaLi3Ti3Fe(PO4)6
Full formulaLi3Ti3Fe1P6O24
Tags
Constituent elementsFe; Li; O; P; Ti;
Number of elements5
Number of sites37
Volume468.72621 Å3
Density2.79905 g/cm3
Source Materials Project

Space group

Spacegroup Number1
Hermann MauguinP1
HallP 1
Crystal SystemTriclinic

Lattice Parameters

a8.670 Å b8.738 Å c8.715 Å
α60.025° β60.071° γ60.440°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-275.95871 eV -7.45834 eV -2.88597 eV 2.43150 eV 5.00000 eV 0.02864 eV