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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116375
  • 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: 4
  • Number of elements: 2
  • Element list: ['Nb', 'F']
  • Chemical System: F-Nb
  • Density: 5.390158977006831
  • Atomic Density: 0.08661761673414657
  • Unit Cell Volume: 46.1799822116684
  • Molar Volume: 6.952558829324081
  • Full Formula: Nb1 F3
  • Reduced Formula: NbF3
  • Formula Anonymous: AB3
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2