Detail information of NiH12(BrO7)2

Structure

Basic information

Pretty formulaNiH12(BrO7)2
Full formulaNi1H12Br2O14
TagsNickel(II) bis(bromate(VII)) hexahydrate;
Nickel bis(bromate(VII)) hexahydrate
Constituent elementsBr; H; Ni; O;
Number of elements4
Number of sites29
Volume291.91319 Å3
Density2.58591 g/cm3
Source Materials Project

Space group

Spacegroup Number147
Hermann MauguinP-3
Hall-P 3
Crystal SystemHexagonal

Lattice Parameters

a7.943 Å b7.943 Å c5.343 Å
α90.000° β89.999° γ120.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-132.89641 eV -4.58264 eV -0.96160 eV 3.03800 eV 2.00000 eV 0.00406 eV