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Table mix-ins: ['Structure'] Extra columns: ['mineral_name', 'aflow_id', 'pearson_symbol', 'strukturbericht_symbol', 'nsites_wyckoff']

Base Information:

  • Database Entry ID: 13
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: AFLOW Prototypes

Structure:

  • Number of sites: 8
  • Number of elements: 2
  • Element list: ['Al', 'Zr']
  • Chemical System: Al-Zr
  • Density: 4.136909120237683
  • Atomic Density: 0.057880581605996774
  • Unit Cell Volume: 138.215611834335
  • Molar Volume: 10.404423371198588
  • Full Formula: Zr2 Al6
  • Reduced Formula: ZrAl3
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm