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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-82505
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 72
  • Number of elements: 3
  • Element list: ['Br', 'Hg', 'Sb']
  • Chemical System: Br-Hg-Sb
  • Density: 6.891680381834098
  • Atomic Density: 0.03149884588568899
  • Unit Cell Volume: 2285.7980340388303
  • Molar Volume: 19.118607652657094
  • Full Formula: Hg24 Sb20 Br28
  • Reduced Formula: Hg6Sb5Br7
  • Formula Anonymous: A5B6C7
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3