Structure

Basic information

Pretty formulaK3Nb4Mo4(PO4)12
Full formulaK3Nb4Mo4P12O48
Tags
Constituent elementsK; Mo; Nb; O; P;
Number of elements5
Number of sites71
Volume1,144.34452 Å3
Density2.92007 g/cm3
Source Materials Project

Space group

Spacegroup Number1
Hermann MauguinP1
HallP 1
Crystal SystemTriclinic

Lattice Parameters

a9.061 Å b10.396 Å c12.151 Å
α90.328° β89.656° γ89.121°

Note: if the model can't be displayed, try Firefox or Chrome.

Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-501.99986 eV -7.07042 eV -2.26558 eV 0.61820 eV 7.00000 eV 0.48780 eV