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  1. Third-Parties
  2. MatprojStructure
  3. mp-1209931

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-1209931
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 3
  • Element list: ['Nd', 'Fe', 'Sb']
  • Chemical System: Fe-Nd-Sb
  • Density: 7.440937496909943
  • Atomic Density: 0.040103433068937995
  • Unit Cell Volume: 648.3235476450576
  • Molar Volume: 15.01652177669655
  • Full Formula: Nd6 Fe6 Sb14
  • Reduced Formula: Nd3Fe3Sb7
  • Formula Anonymous: A3B3C7
  • Spacegroup Number: 176
  • Spacegroup Symbol: P6_3/m
  • Crystal System: hexagonal
  • Pointgroup: 6/m

Thermodynamics:

  • Final energy: -154.21046195
  • Final energy per atom: -5.931171613461538
  • 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.