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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-24907
  • 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: 9
  • Number of elements: 5
  • Element list: ['Sr', 'Fe', 'Se', 'O', 'F']
  • Chemical System: F-Fe-O-Se-Sr
  • Density: 5.335876497455689
  • Atomic Density: 0.05797389866866732
  • Unit Cell Volume: 155.2422763809079
  • Molar Volume: 10.387676002985009
  • Full Formula: Sr2 Fe2 Se2 O1 F2
  • Reduced Formula: Sr2Fe2Se2OF2
  • Formula Anonymous: AB2C2D2E2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm