Detail information of RbMgV5(H8O11)2

Structure

Basic information

Pretty formulaRbMgV5(H8O11)2
Full formulaRb2Mg2V10H32O44
TagsDirubidium dimagnesium decavanadate 16-hydrate
Constituent elementsH; Mg; O; Rb; V;
Number of elements5
Number of sites90
Volume1,149.70191 Å3
Density2.11620 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a10.524 Å b11.517 Å c10.883 Å
α114.972° β85.034° γ105.831°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-516.13087 eV -5.73479 eV -1.63468 eV 1.37010 eV 4.00000 eV 0.25218 eV