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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-758063
  • Created at: Sept. 4, 2022, 3:25 p.m.
  • Last updated at: Sept. 4, 2022, 3:25 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 14
  • Number of elements: 2
  • Element list: ['Tc', 'Zr']
  • Chemical System: Tc-Zr
  • Density: 8.433127489648756
  • Atomic Density: 0.05395363845746285
  • Unit Cell Volume: 259.48203680531435
  • Molar Volume: 11.16169535952217
  • Full Formula: Zr8 Tc6
  • Reduced Formula: Zr4Tc3
  • Formula Anonymous: A3B4
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m