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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-63191
  • 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: 6
  • Number of elements: 3
  • Element list: ['Li', 'B', 'C']
  • Chemical System: B-C-Li
  • Density: 2.1685614404356173
  • Atomic Density: 0.1316350557461993
  • Unit Cell Volume: 45.580563368836785
  • Molar Volume: 4.574876142120582
  • Full Formula: Li2 B2 C2
  • Reduced Formula: LiBC
  • Formula Anonymous: ABC
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm