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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-684592
  • 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: 92
  • Number of elements: 4
  • Element list: ['B', 'N', 'Na', 'O']
  • Chemical System: B-N-Na-O
  • Density: 2.578646612199006
  • Atomic Density: 0.10037437892146045
  • Unit Cell Volume: 916.5685605087219
  • Molar Volume: 5.999679225624023
  • Full Formula: Na12 B24 N4 O52
  • Reduced Formula: Na3B6NO13
  • Formula Anonymous: AB3C6D13
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm