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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-758121
  • Created at: Sept. 4, 2022, 3:24 p.m.
  • Last updated at: Sept. 4, 2022, 3:24 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 2
  • Element list: ['Te', 'Zr']
  • Chemical System: Te-Zr
  • Density: 6.9825965674274135
  • Atomic Density: 0.038432877027997255
  • Unit Cell Volume: 312.23267493761506
  • Molar Volume: 15.669242652880353
  • Full Formula: Zr6 Te6
  • Reduced Formula: ZrTe
  • Formula Anonymous: AB
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m