Structure

Basic information

Pretty formulaNa3CuB8H17O23
Full formulaNa6Cu2B16H34O46
TagsHexasodium decahydroxo-24-oxo-16-boratodicuprate
Constituent elementsB; Cu; H; Na; O;
Number of elements5
Number of sites104
Volume963.00572 Å3
Density2.08342 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a9.207 Å b10.827 Å c11.863 Å
α103.257° β110.024° γ109.729°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-637.70202 eV -6.13175 eV -2.01818 eV 0.61480 eV 0.00000 eV 0.02007 eV