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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-55532
  • 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: 20
  • Number of elements: 3
  • Element list: ['Pb', 'S', 'O']
  • Chemical System: O-Pb-S
  • Density: 6.386821727271044
  • Atomic Density: 0.06694616550944278
  • Unit Cell Volume: 298.7475062657471
  • Molar Volume: 8.995497672156556
  • Full Formula: Pb4 S4 O12
  • Reduced Formula: PbSO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm