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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1719764
  • 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: 10
  • Number of elements: 3
  • Element list: ['Cr', 'Ir', 'O']
  • Chemical System: Cr-Ir-O
  • Density: 8.834658640604202
  • Atomic Density: 0.0910361062673736
  • Unit Cell Volume: 109.84652584579946
  • Molar Volume: 6.615112406403824
  • Full Formula: Cr2 Ir2 O6
  • Reduced Formula: CrIrO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m