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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57430
  • 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: 14
  • Number of elements: 4
  • Element list: ['Ba', 'Mn', 'Bi', 'O']
  • Chemical System: Ba-Bi-Mn-O
  • Density: 6.703571988757607
  • Atomic Density: 0.0345256360799707
  • Unit Cell Volume: 405.4957877552847
  • Molar Volume: 17.44251936749578
  • Full Formula: Ba4 Mn4 Bi4 O2
  • Reduced Formula: Ba2Mn2Bi2O
  • Formula Anonymous: AB2C2D2
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm