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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-107275
  • 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: 5
  • Number of elements: 4
  • Element list: ['Tl', 'Co', 'Ni', 'Se']
  • Chemical System: Co-Ni-Se-Tl
  • Density: 7.841744799655279
  • Atomic Density: 0.04919894707105267
  • Unit Cell Volume: 101.62819120456065
  • Molar Volume: 12.240385452361165
  • Full Formula: Tl1 Co1 Ni1 Se2
  • Reduced Formula: TlCoNiSe2
  • Formula Anonymous: ABCD2
  • Spacegroup Number: 119
  • Spacegroup Symbol: I-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2