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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-26774
  • Created at: Sept. 4, 2022, 3:04 p.m.
  • Last updated at: Sept. 4, 2022, 3:04 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 272
  • Number of elements: 3
  • Element list: ['H', 'Li', 'N']
  • Chemical System: H-Li-N
  • Density: 0.8599545060768371
  • Atomic Density: 0.11728674128196072
  • Unit Cell Volume: 2319.102713802101
  • Molar Volume: 5.134545213019944
  • Full Formula: Li16 H192 N64
  • Reduced Formula: Li(H3N)4
  • Formula Anonymous: AB4C12
  • Spacegroup Number: 198
  • Spacegroup Symbol: P2_13
  • Crystal System: cubic
  • Pointgroup: 23