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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-18858
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Hg', 'Pb', 'Yb']
  • Chemical System: Hg-Pb-Yb
  • Density: 11.855062393054162
  • Atomic Density: 0.03687456974031634
  • Unit Cell Volume: 162.71376296060146
  • Molar Volume: 16.331419735633606
  • Full Formula: Yb2 Hg2 Pb2
  • Reduced Formula: YbHgPb
  • Formula Anonymous: ABC
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm