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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57704
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Tb', 'Ba', 'O']
  • Chemical System: Ba-O-Tb
  • Density: 6.646751436491424
  • Atomic Density: 0.05813741294112133
  • Unit Cell Volume: 172.00627778410953
  • Molar Volume: 10.358460164195687
  • Full Formula: Ba2 Tb2 O6
  • Reduced Formula: BaTbO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 140
  • Spacegroup Symbol: I4/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm