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  1. Third-Parties
  2. MatprojStructure
  3. mp-1221132

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-1221132
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 29
  • Number of elements: 3
  • Element list: ['Pr', 'Gd', 'Mn']
  • Chemical System: Gd-Mn-Pr
  • Density: 7.784479907368056
  • Atomic Density: 0.06299664273179344
  • Unit Cell Volume: 460.3419919291056
  • Molar Volume: 9.559463010813303
  • Full Formula: Pr3 Gd3 Mn23
  • Reduced Formula: Pr3Gd3Mn23
  • Formula Anonymous: A3B3C23
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m

Thermodynamics:

  • Final energy: -243.53679389
  • Final energy per atom: -8.397820478965517
  • 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.