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Table mix-ins: ['Structure'] Extra columns: ['mineral_name', 'aflow_id', 'pearson_symbol', 'strukturbericht_symbol', 'nsites_wyckoff']

Base Information:

  • Database Entry ID: 32
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: AFLOW Prototypes

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Fe', 'O', 'Ti']
  • Chemical System: Fe-O-Ti
  • Density: 4.785746355617606
  • Atomic Density: 0.09498516976823566
  • Unit Cell Volume: 105.27959285012655
  • Molar Volume: 6.340085272989516
  • Full Formula: Ti2 Fe2 O6
  • Reduced Formula: TiFeO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3