Detail information of K2Mn7H18(C9O20)2

Structure

Basic information

Pretty formulaK2Mn7H18(C9O20)2
Full formulaK2Mn7H18C18O40
TagsDipotassium bis(nonaformatooxotrimanganato(III))diaquamanganate(II)
Constituent elementsC; H; K; Mn; O;
Number of elements5
Number of sites85
Volume1,043.93155 Å3
Density2.12683 g/cm3
Source Materials Project

Space group

Spacegroup Number2
Hermann MauguinP-1
Hall-P 1
Crystal SystemTriclinic

Lattice Parameters

a6.991 Å b12.644 Å c15.687 Å
α97.584° β109.503° γ120.622°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-566.27759 eV -6.66209 eV -1.38855 eV 0.01320 eV 25.00014 eV 0.26924 eV