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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-58244
  • 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: 10
  • Number of elements: 4
  • Element list: ['Ba', 'Cu', 'Te', 'O']
  • Chemical System: Ba-Cu-O-Te
  • Density: 6.6843732476329505
  • Atomic Density: 0.07165271369402682
  • Unit Cell Volume: 139.5620554261524
  • Molar Volume: 8.404623425312115
  • Full Formula: Ba2 Cu1 Te1 O6
  • Reduced Formula: Ba2CuTeO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm