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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-20954
  • 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: 32
  • Number of elements: 3
  • Element list: ['Tl', 'Ga', 'S']
  • Chemical System: Ga-S-Tl
  • Density: 5.545400927869405
  • Atomic Density: 0.039493318688508396
  • Unit Cell Volume: 810.2636360441198
  • Molar Volume: 15.248505215522187
  • Full Formula: Tl8 Ga8 S16
  • Reduced Formula: TlGaS2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m