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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12733
  • 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: 12
  • Number of elements: 2
  • Element list: ['Tl', 'Cl']
  • Chemical System: Cl-Tl
  • Density: 4.8372782171273965
  • Atomic Density: 0.03174562577865176
  • Unit Cell Volume: 378.00483391540945
  • Molar Volume: 18.96998598165848
  • Full Formula: Tl4 Cl8
  • Reduced Formula: TlCl2
  • Formula Anonymous: AB2
  • Spacegroup Number: 88
  • Spacegroup Symbol: I4_1/a
  • Crystal System: tetragonal
  • Pointgroup: 4/m