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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91741
  • 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: 8
  • Number of elements: 4
  • Element list: ['Ba', 'Al', 'Ge', 'F']
  • Chemical System: Al-Ba-F-Ge
  • Density: 4.729207008136185
  • Atomic Density: 0.04450914724079212
  • Unit Cell Volume: 179.73833461064586
  • Molar Volume: 13.530119387416114
  • Full Formula: Ba2 Al2 Ge2 F2
  • Reduced Formula: BaAlGeF
  • Formula Anonymous: ABCD
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm