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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57350
  • 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: 14
  • Number of elements: 4
  • Element list: ['Na', 'Ni', 'As', 'O']
  • Chemical System: As-Na-Ni-O
  • Density: 3.8355110832807937
  • Atomic Density: 0.073292917929206
  • Unit Cell Volume: 191.01436258169815
  • Molar Volume: 8.216538418919024
  • Full Formula: Na2 Ni2 As2 O8
  • Reduced Formula: NaNiAsO4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3