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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23183
  • 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: 42
  • Number of elements: 4
  • Element list: ['Sr', 'Cr', 'O', 'F']
  • Chemical System: Cr-F-O-Sr
  • Density: 4.140849621493676
  • Atomic Density: 0.06504604366633072
  • Unit Cell Volume: 645.696457965208
  • Molar Volume: 9.258273709761681
  • Full Formula: Sr10 Cr6 O24 F2
  • Reduced Formula: Sr5Cr3O12F
  • Formula Anonymous: AB3C5D12
  • Spacegroup Number: 176
  • Spacegroup Symbol: P6_3/m
  • Crystal System: hexagonal
  • Pointgroup: 6/m