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  1. Third-Parties
  2. MatprojStructure
  3. mp-600480

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-600480
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 19
  • Number of elements: 3
  • Element list: ['Y', 'Ni', 'Pb']
  • Chemical System: Ni-Pb-Y
  • Density: 5.743735053912523
  • Atomic Density: 0.04041259824409009
  • Unit Cell Volume: 470.15041906588
  • Molar Volume: 14.901642115724828
  • Full Formula: Y12 Ni6 Pb1
  • Reduced Formula: Y12Ni6Pb
  • Formula Anonymous: AB6C12
  • Spacegroup Number: 204
  • Spacegroup Symbol: Im-3
  • Crystal System: cubic
  • Pointgroup: m-3

Thermodynamics:

  • Final energy: -123.07336139
  • Final energy per atom: -6.4775453363157895
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.