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  1. Third-Parties
  2. MatprojStructure
  3. mp-1210437

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-1210437
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 47
  • Number of elements: 3
  • Element list: ['Nd', 'Ni', 'P']
  • Chemical System: Nd-Ni-P
  • Density: 7.65890824333765
  • Atomic Density: 0.06783027758736769
  • Unit Cell Volume: 692.9059067974831
  • Molar Volume: 8.878248732276349
  • Full Formula: Nd9 Ni26 P12
  • Reduced Formula: Nd9(Ni13P6)2
  • Formula Anonymous: A9B12C26
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2

Thermodynamics:

  • Final energy: -294.76196043
  • Final energy per atom: -6.271531072978723
  • 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.