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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112685
  • 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: ['Er', 'Sc', 'S']
  • Chemical System: Er-S-Sc
  • Density: 5.671502990013194
  • Atomic Density: 0.04620962059747842
  • Unit Cell Volume: 432.8103053304741
  • Molar Volume: 13.032222905393466
  • Full Formula: Er6 Sc2 S12
  • Reduced Formula: Er3ScS6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m