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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112705
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 20
  • Number of elements: 4
  • Element list: ['Ba', 'Bi', 'Pb', 'O']
  • Chemical System: Ba-Bi-O-Pb
  • Density: 7.900238441958628
  • Atomic Density: 0.06053427950086727
  • Unit Cell Volume: 330.3913115826127
  • Molar Volume: 9.948314921157559
  • Full Formula: Ba4 Bi1 Pb3 O12
  • Reduced Formula: Ba4Bi(PbO4)3
  • Formula Anonymous: AB3C4D12
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm