Structure

Basic information

Pretty formulaNaBH8O7
Full formulaNa2B2H16O14
TagsSodium di-mue-peroxo-bis(dihydroxoborate) hexahydrate
Constituent elementsB; H; Na; O;
Number of elements4
Number of sites34
Volume302.12457 Å3
Density1.69129 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a6.879 Å b7.392 Å c7.417 Å
α98.321° β102.145° γ120.793°

Note: if the model can't be displayed, try Firefox or Chrome.

Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-181.33210 eV -5.33330 eV -1.59554 eV 3.87570 eV 0.00000 eV 0.00877 eV