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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-14909
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Tl', 'Cd', 'S']
  • Chemical System: Cd-S-Tl
  • Density: 6.801185407155594
  • Atomic Density: 0.04300875094700233
  • Unit Cell Volume: 93.00432846629312
  • Molar Volume: 14.002128932832301
  • Full Formula: Tl1 Cd1 S2
  • Reduced Formula: TlCdS2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1