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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-14907
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Nb', 'Fe', 'B']
  • Chemical System: B-Fe-Nb
  • Density: 7.600066425848458
  • Atomic Density: 0.0860516178392918
  • Unit Cell Volume: 104.58838806271152
  • Molar Volume: 6.998288830835027
  • Full Formula: Nb3 Fe3 B3
  • Reduced Formula: NbFeB
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2