Structure

Basic information

Pretty formulaTiMnFe(PO4)3
Full formulaTi2Mn2Fe2P6O24
Tags
Constituent elementsFe; Mn; O; P; Ti;
Number of elements5
Number of sites36
Volume457.75561 Å3
Density3.21812 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a8.652 Å b8.652 Å c8.652 Å
α59.987° β59.987° γ59.987°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-274.90858 eV -7.63635 eV -2.74085 eV 2.32240 eV 20.00000 eV 0.00000 eV