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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-36109
  • Created at: Sept. 4, 2022, 3:52 p.m.
  • Last updated at: Sept. 4, 2022, 3:52 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 84
  • Number of elements: 4
  • Element list: ['B', 'H', 'Na', 'O']
  • Chemical System: B-H-Na-O
  • Density: 2.0139688361251094
  • Atomic Density: 0.1165809389053504
  • Unit Cell Volume: 720.5294518017034
  • Molar Volume: 5.165630691042255
  • Full Formula: Na6 B12 H30 O36
  • Reduced Formula: NaB2H5O6
  • Formula Anonymous: AB2C5D6
  • Spacegroup Number: 155
  • Spacegroup Symbol: R32H
  • Crystal System: trigonal
  • Pointgroup: 32