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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98840
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 24
  • Number of elements: 2
  • Element list: ['Zr', 'Cu']
  • Chemical System: Cu-Zr
  • Density: 7.09573386016996
  • Atomic Density: 0.05211286630918894
  • Unit Cell Volume: 460.53885920621747
  • Molar Volume: 11.555957648290265
  • Full Formula: Zr16 Cu8
  • Reduced Formula: Zr2Cu
  • Formula Anonymous: AB2
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m