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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12417
  • 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: 10
  • Number of elements: 3
  • Element list: ['Ba', 'Pb', 'O']
  • Chemical System: Ba-O-Pb
  • Density: 7.971650181444958
  • Atomic Density: 0.0611507229328602
  • Unit Cell Volume: 163.53036432585426
  • Molar Volume: 9.84802872504377
  • Full Formula: Ba2 Pb2 O6
  • Reduced Formula: BaPbO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 74
  • Spacegroup Symbol: Imma
  • Crystal System: orthorhombic
  • Pointgroup: mmm