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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-118316
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Sr', 'O', 'F']
  • Chemical System: F-O-Sr
  • Density: 3.9892901054314067
  • Atomic Density: 0.05309486286048062
  • Unit Cell Volume: 94.17106911338465
  • Molar Volume: 11.342228674409814
  • Full Formula: Sr2 O2 F1
  • Reduced Formula: Sr2O2F
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm