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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-121957
  • 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: 22
  • Number of elements: 4
  • Element list: ['Sr', 'Fe', 'Cl', 'O']
  • Chemical System: Cl-Fe-O-Sr
  • Density: 4.807409821440315
  • Atomic Density: 0.06251008631658965
  • Unit Cell Volume: 351.94320303092246
  • Molar Volume: 9.633870491715788
  • Full Formula: Sr6 Fe4 Cl4 O8
  • Reduced Formula: Sr3Fe2(ClO2)2
  • Formula Anonymous: A2B2C3D4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm