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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-87161
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 80
  • Number of elements: 4
  • Element list: ['Y', 'Sc', 'Al', 'O']
  • Chemical System: Al-O-Sc-Y
  • Density: 4.386835547913751
  • Atomic Density: 0.08392482449091816
  • Unit Cell Volume: 953.2340458889743
  • Molar Volume: 7.175637001959628
  • Full Formula: Y12 Sc8 Al12 O48
  • Reduced Formula: Y3Sc2Al3O12
  • Formula Anonymous: A2B3C3D12
  • Spacegroup Number: 230
  • Spacegroup Symbol: Ia-3d
  • Crystal System: cubic
  • Pointgroup: m-3m