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Entry Data

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

Base Information:

  • Database Entry ID: 144
  • 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: ['C', 'Ca', 'O']
  • Chemical System: C-Ca-O
  • Density: 2.7126237062830914
  • Atomic Density: 0.08160809153742887
  • Unit Cell Volume: 122.53686872966001
  • Molar Volume: 7.3793427177965505
  • Full Formula: Ca2 C2 O6
  • Reduced Formula: CaCO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m