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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-49902
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 14
  • Number of elements: 4
  • Element list: ['Li', 'Ti', 'Bi', 'O']
  • Chemical System: Bi-Li-O-Ti
  • Density: 4.6446149274055655
  • Atomic Density: 0.07919517393346848
  • Unit Cell Volume: 176.7784487948892
  • Molar Volume: 7.604176442694822
  • Full Formula: Li2 Ti3 Bi1 O8
  • Reduced Formula: Li2Ti3BiO8
  • Formula Anonymous: AB2C3D8
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m