Structure

Basic information

Pretty formulaNiH20Se2(NO7)2
Full formulaNi2H40Se4N4O28
TagsDiammonium hexaaquanickel selenate
Constituent elementsH; N; Ni; O; Se;
Number of elements5
Number of sites78
Volume983.16723 Å3
Density1.65106 g/cm3
Source Materials Project

Space group

Spacegroup Number14
Hermann MauguinP21/c
Hall-P 2ybc
Crystal SystemMonoclinic

Lattice Parameters

a9.553 Å b14.502 Å c7.345 Å
α90.000° β104.943° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-346.19269 eV -4.43837 eV -0.57793 eV 0.28980 eV 15.89803 eV 0.68894 eV