Structure

Basic information

Pretty formulaSrTiFe(PO4)3
Full formulaSr2Ti2Fe2P6O24
Tags
Constituent elementsFe; O; P; Sr; Ti;
Number of elements5
Number of sites36
Volume486.94901 Å3
Density3.24808 g/cm3
Source Materials Project

Space group

Spacegroup Number161
Hermann MauguinR3c
HallR 3 -2"c
Crystal SystemHexagonal

Lattice Parameters

a9.084 Å b9.084 Å c9.084 Å
α56.485° β56.485° γ56.485°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-270.66859 eV -7.51857 eV -2.94499 eV 2.25250 eV 10.00000 eV 0.00000 eV