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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22526
  • 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: 6
  • Number of elements: 3
  • Element list: ['Sr', 'Br', 'F']
  • Chemical System: Br-F-Sr
  • Density: 4.733386413392521
  • Atomic Density: 0.04584723138947646
  • Unit Cell Volume: 130.8694073373689
  • Molar Volume: 13.135233202723539
  • Full Formula: Sr2 Br2 F2
  • Reduced Formula: SrBrF
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm