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  1. Third-Parties
  2. MatprojStructure
  3. mp-1219819

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-1219819
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Pr', 'Cu', 'Pd']
  • Chemical System: Cu-Pd-Pr
  • Density: 8.991753054538018
  • Atomic Density: 0.059681517239443226
  • Unit Cell Volume: 100.533637171587
  • Molar Volume: 10.090461902701088
  • Full Formula: Pr1 Cu3 Pd2
  • Reduced Formula: PrCu3Pd2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 44
  • Spacegroup Symbol: Imm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -29.72828438
  • Final energy per atom: -4.954714063333333
  • 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.