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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-120551
  • 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: 28
  • Number of elements: 4
  • Element list: ['Ba', 'Co', 'Br', 'O']
  • Chemical System: Ba-Br-Co-O
  • Density: 5.227814522728134
  • Atomic Density: 0.06276026078625778
  • Unit Cell Volume: 446.14218693831475
  • Molar Volume: 9.595468031131304
  • Full Formula: Ba4 Co8 Br2 O14
  • Reduced Formula: Ba2Co4BrO7
  • Formula Anonymous: AB2C4D7
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m