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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-5839
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['K', 'Nb', 'O']
  • Chemical System: K-Nb-O
  • Density: 3.202473107046132
  • Atomic Density: 0.06843031779897092
  • Unit Cell Volume: 175.36086907052857
  • Molar Volume: 8.80039864448878
  • Full Formula: K3 Nb1 O8
  • Reduced Formula: K3NbO8
  • Formula Anonymous: AB3C8
  • Spacegroup Number: 121
  • Spacegroup Symbol: I-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m