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  1. Third-Parties
  2. MatprojStructure
  3. mp-5711

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-5711
  • 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: 40
  • Number of elements: 3
  • Element list: ['Pr', 'Al', 'Co']
  • Chemical System: Al-Co-Pr
  • Density: 6.227361543408948
  • Atomic Density: 0.049060009911115955
  • Unit Cell Volume: 815.3280048754505
  • Molar Volume: 12.275050027324824
  • Full Formula: Pr14 Al14 Co12
  • Reduced Formula: Pr7Al7Co6
  • Formula Anonymous: A6B7C7
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -218.98422599
  • Final energy per atom: -5.47460564975
  • 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.