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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112220
  • 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: 20
  • Number of elements: 5
  • Element list: ['H', 'Pb', 'C', 'S', 'O']
  • Chemical System: C-H-O-Pb-S
  • Density: 3.1640637679247106
  • Atomic Density: 0.09939967910845214
  • Unit Cell Volume: 201.20789301722567
  • Molar Volume: 6.058511268863771
  • Full Formula: H8 Pb1 C6 S1 O4
  • Reduced Formula: H8PbC6SO4
  • Formula Anonymous: ABC4D6E8
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2