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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220166

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-1220166
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['Nd', 'Al', 'Ga']
  • Chemical System: Al-Ga-Nd
  • Density: 5.75446147408871
  • Atomic Density: 0.04314755116420052
  • Unit Cell Volume: 69.52885897471505
  • Molar Volume: 13.95708585426411
  • Full Formula: Nd1 Al1 Ga1
  • Reduced Formula: NdAlGa
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2

Thermodynamics:

  • Final energy: -13.329451690000004
  • Final energy per atom: -4.443150563333335
  • 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.