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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-5407
  • Created at: Sept. 4, 2022, 2:49 p.m.
  • Last updated at: Sept. 4, 2022, 2:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 96
  • Number of elements: 2
  • Element list: ['B', 'H']
  • Chemical System: B-H
  • Density: 0.9932653009380427
  • Atomic Density: 0.12770007939304634
  • Unit Cell Volume: 751.761474670058
  • Molar Volume: 4.715847310841941
  • Full Formula: B36 H60
  • Reduced Formula: B3H5
  • Formula Anonymous: A3B5
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m