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  1. Third-Parties
  2. MatprojStructure
  3. mp-1204360

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-1204360
  • 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: 36
  • Number of elements: 3
  • Element list: ['Pr', 'Co', 'P']
  • Chemical System: Co-P-Pr
  • Density: 7.560659878905785
  • Atomic Density: 0.07195699297685851
  • Unit Cell Volume: 500.29883838500115
  • Molar Volume: 8.369083407830466
  • Full Formula: Pr6 Co18 P12
  • Reduced Formula: PrCo3P2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -251.57335544
  • Final energy per atom: -6.988148762222222
  • 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.