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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111922
  • 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: 22
  • Number of elements: 4
  • Element list: ['Li', 'Ti', 'Fe', 'O']
  • Chemical System: Fe-Li-O-Ti
  • Density: 4.24735817937022
  • Atomic Density: 0.10599506230055664
  • Unit Cell Volume: 207.5568382385343
  • Molar Volume: 5.681529525331837
  • Full Formula: Li4 Ti3 Fe3 O12
  • Reduced Formula: Li4Ti3(FeO4)3
  • Formula Anonymous: A3B3C4D12
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1