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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119459
  • 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: 16
  • Number of elements: 3
  • Element list: ['Li', 'B', 'H']
  • Chemical System: B-H-Li
  • Density: 1.1191407073786097
  • Atomic Density: 0.11161251848172857
  • Unit Cell Volume: 143.35309531268453
  • Molar Volume: 5.395578239716765
  • Full Formula: Li2 B7 H7
  • Reduced Formula: Li2(BH)7
  • Formula Anonymous: A2B7C7
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2