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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111387
  • 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: 5
  • Element list: ['Ba', 'Pr', 'Nb', 'Co', 'O']
  • Chemical System: Ba-Co-Nb-O-Pr
  • Density: 6.831282239280989
  • Atomic Density: 0.07820041887047931
  • Unit Cell Volume: 127.87655289369562
  • Molar Volume: 7.700906014294203
  • Full Formula: Ba1 Pr1 Nb1 Co1 O6
  • Reduced Formula: BaPrNbCoO6
  • Formula Anonymous: ABCDE6
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m