Detail information of CdH18Se4(N2O7)2

Structure

Basic information

Pretty formulaCdH18Se4(N2O7)2
Full formulaCd1H18Se4N4O14
TagsTetraammonium cadmium bis(hydrogenselenate(IV)) bis(selenate(VI))
Constituent elementsCd; H; N; O; Se;
Number of elements5
Number of sites41
Volume424.29687 Å3
Density2.84291 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a5.859 Å b7.467 Å c10.962 Å
α90.015° β105.256° γ112.610°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-207.79188 eV -5.06810 eV -1.06168 eV 3.56800 eV -0.00004 eV 0.11671 eV