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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1759419
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 20
  • Number of elements: 3
  • Element list: ['F', 'K', 'Nd']
  • Chemical System: F-K-Nd
  • Density: 3.5762451675372136
  • Atomic Density: 0.057350426180715244
  • Unit Cell Volume: 348.73324109185495
  • Molar Volume: 10.500603327730833
  • Full Formula: K6 Nd2 F12
  • Reduced Formula: K3NdF6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m