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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1442460
  • Created at: Sept. 4, 2022, 3:50 p.m.
  • Last updated at: Sept. 4, 2022, 3:50 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 2
  • Element list: ['F', 'Nd']
  • Chemical System: F-Nd
  • Density: 6.725863168103414
  • Atomic Density: 0.08051014983824474
  • Unit Cell Volume: 99.36635338616348
  • Molar Volume: 7.479977086242239
  • Full Formula: Nd2 F6
  • Reduced Formula: NdF3
  • Formula Anonymous: AB3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm