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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-106285
  • 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: 10
  • Number of elements: 4
  • Element list: ['Ba', 'Pr', 'Ta', 'O']
  • Chemical System: Ba-O-Pr-Ta
  • Density: 7.052526880066364
  • Atomic Density: 0.06132988579624215
  • Unit Cell Volume: 163.05264342450036
  • Molar Volume: 9.819259699924295
  • Full Formula: Ba2 Pr1 Ta1 O6
  • Reduced Formula: Ba2PrTaO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m