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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12089
  • 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: 20
  • Number of elements: 3
  • Element list: ['Hg', 'Br', 'O']
  • Chemical System: Br-Hg-O
  • Density: 6.257918333119993
  • Atomic Density: 0.0573621916740438
  • Unit Cell Volume: 348.6617128168402
  • Molar Volume: 10.498449561028538
  • Full Formula: Hg4 Br4 O12
  • Reduced Formula: HgBrO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m