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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57887
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 13
  • Number of elements: 3
  • Element list: ['Ba', 'Co', 'O']
  • Chemical System: Ba-Co-O
  • Density: 4.691456128498972
  • Atomic Density: 0.07330211934114224
  • Unit Cell Volume: 177.34821471530765
  • Molar Volume: 8.215507019617585
  • Full Formula: Ba1 Co4 O8
  • Reduced Formula: Ba(CoO2)4
  • Formula Anonymous: AB4C8
  • Spacegroup Number: 162
  • Spacegroup Symbol: P-31m
  • Crystal System: trigonal
  • Pointgroup: -31m