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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98257
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 68
  • Number of elements: 7
  • Element list: ['Li', 'Be', 'H', 'C', 'N', 'O', 'F']
  • Chemical System: Be-C-F-H-Li-N-O
  • Density: 1.651551170164124
  • Atomic Density: 0.11904758596323928
  • Unit Cell Volume: 571.200158741545
  • Molar Volume: 5.058599644229307
  • Full Formula: Li4 Be4 H32 C4 N4 O4 F16
  • Reduced Formula: LiBeH8CNOF4
  • Formula Anonymous: ABCDEF4G8
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m