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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-65776
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ba', 'Ti', 'Te']
  • Chemical System: Ba-Te-Ti
  • Density: 5.120753953187829
  • Atomic Density: 0.028009374436600388
  • Unit Cell Volume: 142.80933010674894
  • Molar Volume: 21.500447193603698
  • Full Formula: Ba1 Ti1 Te2
  • Reduced Formula: BaTiTe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm