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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-90339
  • 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: 9
  • Number of elements: 3
  • Element list: ['Si', 'N', 'F']
  • Chemical System: F-N-Si
  • Density: 2.828800568274628
  • Atomic Density: 0.09014023785336192
  • Unit Cell Volume: 99.84442258340825
  • Molar Volume: 6.680857409980082
  • Full Formula: Si1 N2 F6
  • Reduced Formula: Si(NF3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m