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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23972
  • 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: 12
  • Number of elements: 3
  • Element list: ['H', 'N', 'F']
  • Chemical System: F-H-N
  • Density: 0.9958100235281777
  • Atomic Density: 0.09715036775540972
  • Unit Cell Volume: 123.51986181062904
  • Molar Volume: 6.198783287327971
  • Full Formula: H8 N2 F2
  • Reduced Formula: H4NF
  • Formula Anonymous: ABC4
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm