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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-649922
  • Created at: Sept. 4, 2022, 3:51 p.m.
  • Last updated at: Sept. 4, 2022, 3:51 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 68
  • Number of elements: 4
  • Element list: ['As', 'Br', 'Hg', 'Sn']
  • Chemical System: As-Br-Hg-Sn
  • Density: 6.835875161442633
  • Atomic Density: 0.033303770344285846
  • Unit Cell Volume: 2041.8108609635913
  • Molar Volume: 18.082459426499316
  • Full Formula: Sn4 Hg24 As16 Br24
  • Reduced Formula: SnHg6(As2Br3)2
  • Formula Anonymous: AB4C6D6
  • Spacegroup Number: 198
  • Spacegroup Symbol: P2_13
  • Crystal System: cubic
  • Pointgroup: 23