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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1339569
  • Created at: Sept. 4, 2022, 3:46 p.m.
  • Last updated at: Sept. 4, 2022, 3:46 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 102
  • Number of elements: 2
  • Element list: ['As', 'Li']
  • Chemical System: As-Li
  • Density: 3.3860181924568677
  • Atomic Density: 0.06068762642660407
  • Unit Cell Volume: 1680.7380022245445
  • Molar Volume: 9.923177284389608
  • Full Formula: Li62 As40
  • Reduced Formula: Li31As20
  • Formula Anonymous: A20B31
  • Spacegroup Number: 140
  • Spacegroup Symbol: I4/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm