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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-106337
  • 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: 8
  • Number of elements: 3
  • Element list: ['Sb', 'Pd', 'S']
  • Chemical System: Pd-S-Sb
  • Density: 10.232216166157896
  • Atomic Density: 0.06221516744412587
  • Unit Cell Volume: 128.58600769956348
  • Molar Volume: 9.679537976665188
  • Full Formula: Sb1 Pd6 S1
  • Reduced Formula: SbPd6S
  • Formula Anonymous: ABC6
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m