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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1446306
  • Created at: Sept. 4, 2022, 3:50 p.m.
  • Last updated at: Sept. 4, 2022, 3:50 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['B', 'C', 'Li']
  • Chemical System: B-C-Li
  • Density: 2.4882963684358574
  • Atomic Density: 0.15104346368269012
  • Unit Cell Volume: 59.58549797895967
  • Molar Volume: 3.987025067599896
  • Full Formula: Li3 B3 C3
  • Reduced Formula: LiBC
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m