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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-9196
  • 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', 'Al', 'Cr', 'O']
  • Chemical System: Al-Ba-Cr-O
  • Density: 5.754505446993924
  • Atomic Density: 0.08284604042438307
  • Unit Cell Volume: 168.9881607893906
  • Molar Volume: 7.2690749360515925
  • Full Formula: Ba2 Al1 Cr3 O8
  • Reduced Formula: Ba2AlCr3O8
  • Formula Anonymous: AB2C3D8
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm