Detail information of H13Se2N3O8

Structure

Basic information

Pretty formulaH13Se2N3O8
Full formulaH26Se4N6O16
TagsTriammonium hydrogen bis(selenate(VI)) - IV
Constituent elementsH; N; O; Se;
Number of elements4
Number of sites52
Volume602.71549 Å3
Density1.87919 g/cm3
Source Materials Project

Space group

Spacegroup Number9
Hermann MauguinCc
HallC -2yc
Crystal SystemMonoclinic

Lattice Parameters

a17.322 Å b6.450 Å c6.450 Å
α62.703° β106.765° γ106.765°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-260.87536 eV -5.01683 eV -0.90842 eV 0.00230 eV 0.00000 eV 0.23572 eV