Structure

Basic information

Pretty formulaK3LiMn4(MoO4)6
Full formulaK6Li2Mn8Mo12O48
Tags
Constituent elementsK; Li; Mn; Mo; O;
Number of elements5
Number of sites76
Volume1,277.84319 Å3
Density3.38806 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a10.881 Å b10.881 Å c10.881 Å
α85.720° β85.720° γ85.720°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-529.69729 eV -6.96970 eV -2.21430 eV 3.07860 eV 40.00069 eV 0.00000 eV