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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-72219
  • 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: ['Ce', 'P', 'Si']
  • Chemical System: Ce-P-Si
  • Density: 3.384516587698381
  • Atomic Density: 0.04800421929252395
  • Unit Cell Volume: 1499.8681586977311
  • Molar Volume: 12.545023851555216
  • Full Formula: Ce8 Si16 P48
  • Reduced Formula: Ce(SiP3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2