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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29769
  • 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: 3
  • Element list: ['Ge', 'Pb', 'S']
  • Chemical System: Ge-Pb-S
  • Density: 4.9164638826594205
  • Atomic Density: 0.039368193855708805
  • Unit Cell Volume: 508.0243222054696
  • Molar Volume: 15.296969889124659
  • Full Formula: Ge4 Pb4 S12
  • Reduced Formula: GePbS3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m