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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-30975
  • 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: 32
  • Number of elements: 3
  • Element list: ['H', 'N', 'F']
  • Chemical System: F-H-N
  • Density: 1.5393050165131574
  • Atomic Density: 0.1300054757822287
  • Unit Cell Volume: 246.14347824550853
  • Molar Volume: 4.632220853595157
  • Full Formula: H20 N4 F8
  • Reduced Formula: H5NF2
  • Formula Anonymous: AB2C5
  • Spacegroup Number: 53
  • Spacegroup Symbol: Pmna
  • Crystal System: orthorhombic
  • Pointgroup: mmm