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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-711323
  • Created at: Sept. 4, 2022, 3:19 p.m.
  • Last updated at: Sept. 4, 2022, 3:19 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 80
  • Number of elements: 3
  • Element list: ['Al', 'Na', 'O']
  • Chemical System: Al-Na-O
  • Density: 2.5351728095002604
  • Atomic Density: 0.074138381507551
  • Unit Cell Volume: 1079.0632108936986
  • Molar Volume: 8.122838181174274
  • Full Formula: Na40 Al8 O32
  • Reduced Formula: Na5AlO4
  • Formula Anonymous: AB4C5
  • Spacegroup Number: 61
  • Spacegroup Symbol: Pbca
  • Crystal System: orthorhombic
  • Pointgroup: mmm