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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-26915
  • 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: 24
  • Number of elements: 3
  • Element list: ['Tl', 'In', 'S']
  • Chemical System: In-S-Tl
  • Density: 5.182576632751412
  • Atomic Density: 0.03857623126885287
  • Unit Cell Volume: 622.1447562550783
  • Molar Volume: 15.611013730266551
  • Full Formula: Tl2 In10 S12
  • Reduced Formula: TlIn5S6
  • Formula Anonymous: AB5C6
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m