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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-10301
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Li', 'B', 'N']
  • Chemical System: B-Li-N
  • Density: 1.77922992233188
  • Atomic Density: 0.10778112414344208
  • Unit Cell Volume: 111.33674931827233
  • Molar Volume: 5.587379801295585
  • Full Formula: Li6 B2 N4
  • Reduced Formula: Li3BN2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 136
  • Spacegroup Symbol: P4_2/mnm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm