Detail information of UH12C2S2N6O13

Structure

Basic information

Pretty formulaUH12C2S2N6O13
Full formulaU2H24C4S4N12O26
TagsGuanidinium uranyl sulfate trihydrate
Constituent elementsC; H; N; O; S; U;
Number of elements6
Number of sites72
Volume835.99107 Å3
Density2.50398 g/cm3
Source Materials Project

Space group

Spacegroup Number15
Hermann MauguinC2/c
Hall-C 2yc
Crystal SystemMonoclinic

Lattice Parameters

a6.926 Å b6.926 Å c18.631 Å
α81.803° β98.197° γ108.155°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-434.17567 eV -6.03022 eV -1.04064 eV 0.14500 eV 12.00000 eV 0.40518 eV