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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1535801
  • Created at: Sept. 4, 2022, 3:55 p.m.
  • Last updated at: Sept. 4, 2022, 3:55 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Ac', 'Bi', 'Te']
  • Chemical System: Ac-Bi-Te
  • Density: 5.311111280921501
  • Atomic Density: 0.020149957092444805
  • Unit Cell Volume: 446.6510751714968
  • Molar Volume: 29.886618280978833
  • Full Formula: Ac2 Bi1 Te6
  • Reduced Formula: Ac2BiTe6
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm