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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-14038
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 16
  • Number of elements: 3
  • Element list: ['Hg', 'I', 'O']
  • Chemical System: Hg-I-O
  • Density: 8.575330568367203
  • Atomic Density: 0.03796609354663238
  • Unit Cell Volume: 421.4286618755701
  • Molar Volume: 15.861892013207056
  • Full Formula: Hg8 I4 O4
  • Reduced Formula: Hg2IO
  • Formula Anonymous: ABC2
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m