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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1443303
  • Created at: Sept. 4, 2022, 3:50 p.m.
  • Last updated at: Sept. 4, 2022, 3:50 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 2
  • Number of elements: 2
  • Element list: ['Cl', 'Li']
  • Chemical System: Cl-Li
  • Density: 0.9613578380829296
  • Atomic Density: 0.02731250754194176
  • Unit Cell Volume: 73.22652440200706
  • Molar Volume: 22.04902186572307
  • Full Formula: Li1 Cl1
  • Reduced Formula: LiCl
  • Formula Anonymous: AB
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm