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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1739343
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Br', 'O', 'Sm']
  • Chemical System: Br-O-Sm
  • Density: 5.414680108948864
  • Atomic Density: 0.06648770848333077
  • Unit Cell Volume: 180.4844876404266
  • Molar Volume: 9.057524913059412
  • Full Formula: Sm2 Br2 O8
  • Reduced Formula: SmBrO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 141
  • Spacegroup Symbol: I4_1/amd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm