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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1371029
  • 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: 4
  • Number of elements: 3
  • Element list: ['Pt', 'Zn', 'Zr']
  • Chemical System: Pt-Zn-Zr
  • Density: 13.749294314439501
  • Atomic Density: 0.06057061764030157
  • Unit Cell Volume: 66.03861997501805
  • Molar Volume: 9.942346627142658
  • Full Formula: Zr1 Zn1 Pt2
  • Reduced Formula: ZrZnPt2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm