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  1. Third-Parties
  2. MatprojStructure
  3. mp-11396

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-11396
  • 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: 8
  • Number of elements: 3
  • Element list: ['Nd', 'Ga', 'Ni']
  • Chemical System: Ga-Nd-Ni
  • Density: 7.376386710719399
  • Atomic Density: 0.051897257371453925
  • Unit Cell Volume: 154.1507279034055
  • Molar Volume: 11.603967271134595
  • Full Formula: Nd2 Ga4 Ni2
  • Reduced Formula: NdGa2Ni
  • Formula Anonymous: ABC2
  • Spacegroup Number: 65
  • Spacegroup Symbol: Cmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -38.19587339
  • Final energy per atom: -4.77448417375
  • 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.