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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-9390
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Hg', 'S', 'O']
  • Chemical System: Hg-O-S
  • Density: 6.27076413535751
  • Atomic Density: 0.07637908646463815
  • Unit Cell Volume: 157.11106999892883
  • Molar Volume: 7.884541487398021
  • Full Formula: Hg2 S2 O8
  • Reduced Formula: HgSO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 31
  • Spacegroup Symbol: Pmn2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2