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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-88650
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 32
  • Number of elements: 3
  • Element list: ['Hg', 'Cl', 'O']
  • Chemical System: Cl-Hg-O
  • Density: 6.238324893351833
  • Atomic Density: 0.039567130661555906
  • Unit Cell Volume: 808.7520996586125
  • Molar Volume: 15.220059325280351
  • Full Formula: Hg12 Cl16 O4
  • Reduced Formula: Hg3Cl4O
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 198
  • Spacegroup Symbol: P2_13
  • Crystal System: cubic
  • Pointgroup: 23