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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220328

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-1220328
  • 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: ['Nd', 'Al', 'Ga']
  • Chemical System: Al-Ga-Nd
  • Density: 5.352073164007639
  • Atomic Density: 0.04403618723419151
  • Unit Cell Volume: 136.25157800540353
  • Molar Volume: 13.675436358677668
  • Full Formula: Nd2 Al3 Ga1
  • Reduced Formula: Nd2Al3Ga
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -26.939574470000004
  • Final energy per atom: -4.489929078333334
  • 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.