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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-23979
  • Created at: Sept. 4, 2022, 2:59 p.m.
  • Last updated at: Sept. 4, 2022, 2:59 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['B', 'H', 'Na']
  • Chemical System: B-H-Na
  • Density: 0.902262118850269
  • Atomic Density: 0.08617266020671226
  • Unit Cell Volume: 139.25530407456637
  • Molar Volume: 6.9884586892803355
  • Full Formula: Na2 B2 H8
  • Reduced Formula: NaBH4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m