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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98641
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 50
  • Number of elements: 5
  • Element list: ['Ga', 'H', 'N', 'O', 'F']
  • Chemical System: F-Ga-H-N-O
  • Density: 2.2721796807509005
  • Atomic Density: 0.1196824120230143
  • Unit Cell Volume: 417.77232890648344
  • Molar Volume: 5.0317675406157205
  • Full Formula: Ga2 H24 N6 O6 F12
  • Reduced Formula: GaH12N3(OF2)3
  • Formula Anonymous: AB3C3D6E12
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1