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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-40650
  • 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: 28
  • Number of elements: 3
  • Element list: ['Fe', 'Cu', 'O']
  • Chemical System: Cu-Fe-O
  • Density: 5.83882920389028
  • Atomic Density: 0.10371980567099359
  • Unit Cell Volume: 269.95808388629206
  • Molar Volume: 5.806162787368353
  • Full Formula: Fe9 Cu3 O16
  • Reduced Formula: Fe9Cu3O16
  • Formula Anonymous: A3B9C16
  • Spacegroup Number: 115
  • Spacegroup Symbol: P-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2