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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-15896
  • 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: 5
  • Number of elements: 3
  • Element list: ['Sc', 'Tl', 'B']
  • Chemical System: B-Sc-Tl
  • Density: 5.718113776879058
  • Atomic Density: 0.04918454804673682
  • Unit Cell Volume: 101.65794336971098
  • Molar Volume: 12.243968886890165
  • Full Formula: Sc3 Tl1 B1
  • Reduced Formula: Sc3TlB
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m