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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-85533
  • 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: 16
  • Number of elements: 2
  • Element list: ['Ba', 'Pb']
  • Chemical System: Ba-Pb
  • Density: 8.09940686613057
  • Atomic Density: 0.026948291855876355
  • Unit Cell Volume: 593.7296540192782
  • Molar Volume: 22.347022186813703
  • Full Formula: Ba6 Pb10
  • Reduced Formula: Ba3Pb5
  • Formula Anonymous: A3B5
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm