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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-19079
  • 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: 24
  • Number of elements: 3
  • Element list: ['Na', 'B', 'O']
  • Chemical System: B-Na-O
  • Density: 2.508251761748028
  • Atomic Density: 0.09182458390696986
  • Unit Cell Volume: 261.3679145479722
  • Molar Volume: 6.558309881481418
  • Full Formula: Na6 B6 O12
  • Reduced Formula: NaBO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m