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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-8518
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Tl', 'In', 'Se']
  • Chemical System: In-Se-Tl
  • Density: 6.888578962626071
  • Atomic Density: 0.03477857070195353
  • Unit Cell Volume: 230.02670433350025
  • Molar Volume: 17.315664900690507
  • Full Formula: Tl2 In2 Se4
  • Reduced Formula: TlInSe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 140
  • Spacegroup Symbol: I4/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm