Detail information of K3GdH6(C2O5)3

Structure

Basic information

Pretty formulaK3GdH6(C2O5)3
Full formulaK6Gd2H12C12O30
TagsTripotassium mue-oxalato-dioxalatoaquagadoliniate(III) dihydrate
Constituent elementsC; Gd; H; K; O;
Number of elements5
Number of sites62
Volume788.74287 Å3
Density2.49540 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a9.468 Å b8.645 Å c9.809 Å
α88.155° β82.049° γ96.709°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-427.62413 eV -6.89716 eV -1.87503 eV 2.97340 eV 14.00000 eV 0.05457 eV