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  1. Third-Parties
  2. MatprojStructure
  3. mp-866656

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-866656
  • 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: 24
  • Number of elements: 3
  • Element list: ['Gd', 'Fe', 'B']
  • Chemical System: B-Fe-Gd
  • Density: 7.350196129175867
  • Atomic Density: 0.10360635498804524
  • Unit Cell Volume: 231.64602212643493
  • Molar Volume: 5.812520632247773
  • Full Formula: Gd4 Fe4 B16
  • Reduced Formula: GdFeB4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 55
  • Spacegroup Symbol: Pbam
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -210.98442311
  • Final energy per atom: -8.791017629583333
  • 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.