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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1276825
  • Created at: Sept. 4, 2022, 3:42 p.m.
  • Last updated at: Sept. 4, 2022, 3:42 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Hg', 'O', 'Sc']
  • Chemical System: Hg-O-Sc
  • Density: 9.467535253722287
  • Atomic Density: 0.09711458625319154
  • Unit Cell Volume: 102.97114353068011
  • Molar Volume: 6.20106720559919
  • Full Formula: Sc2 Hg2 O6
  • Reduced Formula: ScHgO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m