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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-21531
  • Created at: Sept. 4, 2022, 3:20 p.m.
  • Last updated at: Sept. 4, 2022, 3:20 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 40
  • Number of elements: 4
  • Element list: ['B', 'H', 'Li', 'N']
  • Chemical System: B-H-Li-N
  • Density: 0.7583875520010864
  • Atomic Density: 0.1176658845754877
  • Unit Cell Volume: 339.94560228150317
  • Molar Volume: 5.118000669205474
  • Full Formula: Li4 B4 H28 N4
  • Reduced Formula: LiBH7N
  • Formula Anonymous: ABCD7
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm