Detail information of Na2Ni(H7N3)2

Structure

Basic information

Pretty formulaNa2Ni(H7N3)2
Full formulaNa4Ni2H28N12
TagsSodium tetraamidoniccolate diammonia
Constituent elementsH; N; Na; Ni;
Number of elements4
Number of sites46
Volume465.85738 Å3
Density1.44593 g/cm3
Source Materials Project

Space group

Spacegroup Number87
Hermann MauguinI4/m
Hall-I 4
Crystal SystemTetragonal

Lattice Parameters

a8.558 Å b8.558 Å c8.558 Å
α116.074° β116.074° γ96.946°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-225.37874 eV -4.89954 eV -0.48763 eV 1.06260 eV 0.00000 eV 0.01968 eV