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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112704
  • 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: 19
  • Number of elements: 4
  • Element list: ['Ba', 'La', 'Nb', 'O']
  • Chemical System: Ba-La-Nb-O
  • Density: 6.252664791661667
  • Atomic Density: 0.07003085711110384
  • Unit Cell Volume: 271.3089741263131
  • Molar Volume: 8.599267534946609
  • Full Formula: Ba3 La1 Nb3 O12
  • Reduced Formula: Ba3LaNb3O12
  • Formula Anonymous: AB3C3D12
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m