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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98010
  • 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: 30
  • Number of elements: 2
  • Element list: ['Ba', 'Li']
  • Chemical System: Ba-Li
  • Density: 1.8914483910710242
  • Atomic Density: 0.034497848020914434
  • Unit Cell Volume: 869.619460953402
  • Molar Volume: 17.456569338322367
  • Full Formula: Ba6 Li24
  • Reduced Formula: BaLi4
  • Formula Anonymous: AB4
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm