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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-89948
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 5
  • Element list: ['Sr', 'Ti', 'Sb', 'O', 'F']
  • Chemical System: F-O-Sb-Sr-Ti
  • Density: 5.307623586093512
  • Atomic Density: 0.05060233296718624
  • Unit Cell Volume: 177.8574123417624
  • Molar Volume: 11.900915248127271
  • Full Formula: Sr2 Ti2 Sb2 O1 F2
  • Reduced Formula: Sr2Ti2Sb2OF2
  • Formula Anonymous: AB2C2D2E2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm