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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-16221
  • 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: 5
  • Number of elements: 3
  • Element list: ['Ti', 'Tl', 'N']
  • Chemical System: N-Ti-Tl
  • Density: 8.078286293415246
  • Atomic Density: 0.06719583798400676
  • Unit Cell Volume: 74.40937043139557
  • Molar Volume: 8.96207405201692
  • Full Formula: Ti3 Tl1 N1
  • Reduced Formula: Ti3TlN
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m