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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-115385
  • 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: 3
  • Number of elements: 2
  • Element list: ['Pb', 'S']
  • Chemical System: Pb-S
  • Density: 2.0101795995707934
  • Atomic Density: 0.01338471732467385
  • Unit Cell Volume: 224.13622396564898
  • Molar Volume: 44.992663004534116
  • Full Formula: Pb1 S2
  • Reduced Formula: PbS2
  • Formula Anonymous: AB2
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m