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  1. Third-Parties
  2. MatprojStructure
  3. mp-1210590

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-1210590
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 112
  • Number of elements: 3
  • Element list: ['Nd', 'Co', 'B']
  • Chemical System: B-Co-Nd
  • Density: 8.544299984183194
  • Atomic Density: 0.08594345824239083
  • Unit Cell Volume: 1303.1823746738296
  • Molar Volume: 7.007096157354341
  • Full Formula: Nd8 Co92 B12
  • Reduced Formula: Nd2Co23B3
  • Formula Anonymous: A2B3C23
  • Spacegroup Number: 220
  • Spacegroup Symbol: I-43d
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -786.1883307
  • Final energy per atom: -7.019538666964286
  • 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.