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  1. Third-Parties
  2. MatprojStructure
  3. mp-1219849

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-1219849
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Pr', 'Ga', 'Cu']
  • Chemical System: Cu-Ga-Pr
  • Density: 6.892692972825946
  • Atomic Density: 0.04491235264745524
  • Unit Cell Volume: 133.5935359943778
  • Molar Volume: 13.408651306404494
  • Full Formula: Pr2 Ga3 Cu1
  • Reduced Formula: Pr2Ga3Cu
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1

Thermodynamics:

  • Final energy: -26.07952289
  • Final energy per atom: -4.346587148333334
  • 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.