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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29505
  • 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: 3
  • Element list: ['Tl', 'Sb', 'O']
  • Chemical System: O-Sb-Tl
  • Density: 6.9289353201046415
  • Atomic Density: 0.05576369345424897
  • Unit Cell Volume: 358.65630056246
  • Molar Volume: 10.799393632240006
  • Full Formula: Tl4 Sb4 O12
  • Reduced Formula: TlSbO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 182
  • Spacegroup Symbol: P6_322
  • Crystal System: hexagonal
  • Pointgroup: 622