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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1344140
  • Created at: Sept. 4, 2022, 3:45 p.m.
  • Last updated at: Sept. 4, 2022, 3:45 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 28
  • Number of elements: 4
  • Element list: ['Cs', 'F', 'P', 'Se']
  • Chemical System: Cs-F-P-Se
  • Density: 7.5354975363983225
  • Atomic Density: 0.0574778388413617
  • Unit Cell Volume: 487.1442727218701
  • Molar Volume: 10.477326359853322
  • Full Formula: Cs8 P4 Se12 F4
  • Reduced Formula: Cs2PSe3F
  • Formula Anonymous: ABC2D3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm