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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109640
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 7
  • Number of elements: 3
  • Element list: ['Tl', 'Co', 'F']
  • Chemical System: Co-F-Tl
  • Density: 7.661498879253445
  • Atomic Density: 0.05940303271334552
  • Unit Cell Volume: 117.83910147785056
  • Molar Volume: 10.13776651616486
  • Full Formula: Tl2 Co1 F4
  • Reduced Formula: Tl2CoF4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm