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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-87845
  • 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: 20
  • Number of elements: 4
  • Element list: ['K', 'Tl', 'C', 'N']
  • Chemical System: C-K-N-Tl
  • Density: 2.854538573979587
  • Atomic Density: 0.0494615846623329
  • Unit Cell Volume: 404.3542101721389
  • Molar Volume: 12.17538985277622
  • Full Formula: K2 Tl2 C8 N8
  • Reduced Formula: KTl(CN)4
  • Formula Anonymous: ABC4D4
  • Spacegroup Number: 88
  • Spacegroup Symbol: I4_1/a
  • Crystal System: tetragonal
  • Pointgroup: 4/m