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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-51415
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Y', 'O', 'F']
  • Chemical System: F-O-Y
  • Density: 5.1696894390276915
  • Atomic Density: 0.07537936943913037
  • Unit Cell Volume: 79.5973758422729
  • Molar Volume: 7.989110024146517
  • Full Formula: Y2 O2 F2
  • Reduced Formula: YOF
  • Formula Anonymous: ABC
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m