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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-42852
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Pr', 'Cu', 'Ir']
  • Chemical System: Cu-Ir-Pr
  • Density: 9.679807765491423
  • Atomic Density: 0.04337464136009604
  • Unit Cell Volume: 92.21978267882427
  • Molar Volume: 13.88401280371224
  • Full Formula: Pr2 Cu1 Ir1
  • Reduced Formula: Pr2CuIr
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m