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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220336

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-1220336
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 19
  • Number of elements: 3
  • Element list: ['Nd', 'Fe', 'Co']
  • Chemical System: Co-Fe-Nd
  • Density: 8.446687466717876
  • Atomic Density: 0.07562433909909927
  • Unit Cell Volume: 251.24186507074285
  • Molar Volume: 7.963230927689161
  • Full Formula: Nd2 Fe4 Co13
  • Reduced Formula: Nd2Fe4Co13
  • Formula Anonymous: A2B4C13
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m

Thermodynamics:

  • Final energy: -136.88414044
  • Final energy per atom: -7.204428444210527
  • 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.