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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-9412
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Pr', 'Al', 'O']
  • Chemical System: Al-O-Pr
  • Density: 6.559838233352575
  • Atomic Density: 0.091492767303154
  • Unit Cell Volume: 109.29825706184835
  • Molar Volume: 6.582094888491147
  • Full Formula: Pr2 Al2 O6
  • Reduced Formula: PrAlO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m