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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-30217
  • 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: 20
  • Number of elements: 4
  • Element list: ['Ga', 'H', 'N', 'F']
  • Chemical System: F-Ga-H-N
  • Density: 2.942974374282776
  • Atomic Density: 0.1258978477773937
  • Unit Cell Volume: 158.8589507531773
  • Molar Volume: 4.783354812107708
  • Full Formula: Ga2 H10 N4 F4
  • Reduced Formula: GaH5(NF)2
  • Formula Anonymous: AB2C2D5
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m