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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1018691
  • Created at: Sept. 4, 2022, 3:28 p.m.
  • Last updated at: Sept. 4, 2022, 3:28 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 16
  • Number of elements: 3
  • Element list: ['Ru', 'Tc', 'Zr']
  • Chemical System: Ru-Tc-Zr
  • Density: 9.034576735498428
  • Atomic Density: 0.05704317261780035
  • Unit Cell Volume: 280.48930775998235
  • Molar Volume: 10.55716308128484
  • Full Formula: Zr8 Tc4 Ru4
  • Reduced Formula: Zr2TcRu
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm