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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-19564
  • Created at: Sept. 4, 2022, 2:49 p.m.
  • Last updated at: Sept. 4, 2022, 2:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 104
  • Number of elements: 5
  • Element list: ['Al', 'C', 'H', 'Li', 'N']
  • Chemical System: Al-C-H-Li-N
  • Density: 1.4428986463131297
  • Atomic Density: 0.14658967796455885
  • Unit Cell Volume: 709.4633226845904
  • Molar Volume: 4.108161531984523
  • Full Formula: Li4 Al4 H64 C16 N16
  • Reduced Formula: LiAlH16(CN)4
  • Formula Anonymous: ABC4D4E16
  • Spacegroup Number: 80
  • Spacegroup Symbol: I4_1
  • Crystal System: tetragonal
  • Pointgroup: 4