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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-60098
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 30
  • Number of elements: 3
  • Element list: ['Y', 'Fe', 'O']
  • Chemical System: Fe-O-Y
  • Density: 5.106655102398621
  • Atomic Density: 0.0797747014837279
  • Unit Cell Volume: 376.05906937952346
  • Molar Volume: 7.548935499593654
  • Full Formula: Y6 Fe6 O18
  • Reduced Formula: YFeO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 185
  • Spacegroup Symbol: P6_3cm
  • Crystal System: hexagonal
  • Pointgroup: 6mm