Structure

Basic information

Pretty formulaRb3LiZn2(MoO4)4
Full formulaRb6Li2Zn4Mo8O32
Tags
Constituent elementsLi; Mo; O; Rb; Zn;
Number of elements5
Number of sites52
Volume890.12324 Å3
Density3.85756 g/cm3
Source Materials Project

Space group

Spacegroup Number122
Hermann MauguinI-42d
HallI -4 2bw
Crystal SystemTetragonal

Lattice Parameters

a10.496 Å b10.496 Å c10.496 Å
α109.307° β109.307° γ109.800°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-321.31132 eV -6.17906 eV -2.16344 eV 4.02780 eV 0.00000 eV 0.00290 eV