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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-105608
  • 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: 4
  • Number of elements: 3
  • Element list: ['Zr', 'Zn', 'Pd']
  • Chemical System: Pd-Zn-Zr
  • Density: 9.197959825196133
  • Atomic Density: 0.05996801800542739
  • Unit Cell Volume: 66.70222116792289
  • Molar Volume: 10.04225412194708
  • Full Formula: Zr1 Zn1 Pd2
  • Reduced Formula: ZrZnPd2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m