Formula Mn6P24
Reduced formula MnP4
Stoichiometry AB4
Number of species 2
Number of atoms 30
Unique ID Mn6P24
Unit cell volume [Å3] 435.730
Heat of formation [eV/atom] -0.364
Energy [eV] -197.982
Maximum force [eV/Å] 0.038
Maximum stress component [eV/Å3] 0.012
  XYZ CIF JSON
Axis x [Å] y [Å] z [Å] Periodic
1 16.304 -0.011 -0.004 Yes
2 0.076 5.837 0.002 Yes
3 -0.457 -2.201 4.578 Yes
Lengths [Å] 16.304 5.838 5.100
Angles [°] 115.617 95.135 89.288
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