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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-17766
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 4
  • Element list: ['Zr', 'Cu', 'Si', 'P']
  • Chemical System: Cu-P-Si-Zr
  • Density: 5.707295063348797
  • Atomic Density: 0.06429453840086145
  • Unit Cell Volume: 124.42736504494155
  • Molar Volume: 9.366488833706772
  • Full Formula: Zr2 Cu2 Si2 P2
  • Reduced Formula: ZrCuSiP
  • Formula Anonymous: ABCD
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm