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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-99559
  • 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: 6
  • Number of elements: 3
  • Element list: ['Ba', 'Hg', 'Pb']
  • Chemical System: Ba-Hg-Pb
  • Density: 8.953013411427753
  • Atomic Density: 0.029672331082181282
  • Unit Cell Volume: 202.2085822439174
  • Molar Volume: 20.29547575254846
  • Full Formula: Ba2 Hg2 Pb2
  • Reduced Formula: BaHgPb
  • Formula Anonymous: ABC
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m