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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-66381
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 72
  • Number of elements: 3
  • Element list: ['Br', 'Cd', 'P']
  • Chemical System: Br-Cd-P
  • Density: 5.1317185966828065
  • Atomic Density: 0.03702037549147971
  • Unit Cell Volume: 1944.8749247983963
  • Molar Volume: 16.267097996847717
  • Full Formula: Cd32 P16 Br24
  • Reduced Formula: Cd4P2Br3
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3