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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1728044
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 10
  • Number of elements: 4
  • Element list: ['Cr', 'H', 'Li', 'Tl']
  • Chemical System: Cr-H-Li-Tl
  • Density: 7.9615415467499435
  • Atomic Density: 0.10120398578225706
  • Unit Cell Volume: 98.81033758408738
  • Molar Volume: 5.950497614744925
  • Full Formula: Li1 Tl2 Cr1 H6
  • Reduced Formula: LiTl2CrH6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m