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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-48462
  • 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: 8
  • Number of elements: 4
  • Element list: ['Li', 'Co', 'O', 'F']
  • Chemical System: Co-F-Li-O
  • Density: 3.678759006804526
  • Atomic Density: 0.11602690867266623
  • Unit Cell Volume: 68.94952292980163
  • Molar Volume: 5.190296655226413
  • Full Formula: Li3 Co1 O1 F3
  • Reduced Formula: Li3CoOF3
  • Formula Anonymous: ABC3D3
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm