Detail information of Mn3H24(O3F2)4

Structure

Basic information

Pretty formulaMn3H24(O3F2)4
Full formulaMn3H24O12F8
TagsHexaaquamanganese bis(diaquatetrafluoromanganese(III)) dihydrate
Constituent elementsF; H; Mn; O;
Number of elements4
Number of sites47
Volume441.49336 Å3
Density2.00466 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a6.275 Å b8.998 Å c9.408 Å
α110.612° β103.362° γ106.905°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-243.40957 eV -5.17893 eV -1.72462 eV 0.98210 eV 13.00000 eV 0.00944 eV