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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-99968
  • 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: 10
  • Number of elements: 4
  • Element list: ['Li', 'Nb', 'O', 'F']
  • Chemical System: F-Li-Nb-O
  • Density: 4.381600562416791
  • Atomic Density: 0.08746291974933754
  • Unit Cell Volume: 114.33416616617971
  • Molar Volume: 6.885364423299638
  • Full Formula: Li2 Nb2 O4 F2
  • Reduced Formula: LiNbO2F
  • Formula Anonymous: ABCD2
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m