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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-114484
  • 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: 3
  • Number of elements: 3
  • Element list: ['B', 'C', 'F']
  • Chemical System: B-C-F
  • Density: 3.0972654966019495
  • Atomic Density: 0.13380288931047427
  • Unit Cell Volume: 22.421040498152802
  • Molar Volume: 4.500755395517889
  • Full Formula: B1 C1 F1
  • Reduced Formula: BCF
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2