Detail information of H3Os4C12ClO12

Structure

Basic information

Pretty formulaH3Os4C12ClO12
Full formulaH12Os16C48Cl4O48
Tagsmue-Chloro-tri-mue-hydrido-tetrahedro-tetrakis(tricarbony osmium)
Constituent elementsC; Cl; H; O; Os;
Number of elements5
Number of sites128
Volume2,118.40896 Å3
Density3.56036 g/cm3
Source Materials Project

Space group

Spacegroup Number14
Hermann MauguinP21/c
Hall-P 2ybc
Crystal SystemMonoclinic

Lattice Parameters

a9.648 Å b16.888 Å c13.109 Å
α90.000° β97.325° γ90.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-986.43497 eV -7.70652 eV -0.91442 eV 2.57690 eV 0.00041 eV 0.20075 eV