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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103118
  • 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: 7
  • Number of elements: 4
  • Element list: ['Ca', 'La', 'Fe', 'O']
  • Chemical System: Ca-Fe-La-O
  • Density: 5.603299606298307
  • Atomic Density: 0.07904498182795598
  • Unit Cell Volume: 88.55717134878634
  • Molar Volume: 7.618625016711863
  • Full Formula: Ca1 La1 Fe1 O4
  • Reduced Formula: CaLaFeO4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm