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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111350
  • 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: 10
  • Number of elements: 4
  • Element list: ['Na', 'Ti', 'Bi', 'O']
  • Chemical System: Bi-Na-O-Ti
  • Density: 5.5771847596560615
  • Atomic Density: 0.0792696401986349
  • Unit Cell Volume: 126.15170164695928
  • Molar Volume: 7.597033044315126
  • Full Formula: Na1 Ti2 Bi1 O6
  • Reduced Formula: NaTi2BiO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm