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  1. Third-Parties
  2. MatprojStructure
  3. mp-1210154

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-1210154
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 3
  • Element list: ['Nd', 'Ni', 'Bi']
  • Chemical System: Bi-Nd-Ni
  • Density: 10.058646354250927
  • Atomic Density: 0.04192802562620667
  • Unit Cell Volume: 477.0079129960084
  • Molar Volume: 14.363043978478979
  • Full Formula: Nd6 Ni6 Bi8
  • Reduced Formula: Nd3Ni3Bi4
  • Formula Anonymous: A3B3C4
  • Spacegroup Number: 220
  • Spacegroup Symbol: I-43d
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -106.04749118
  • Final energy per atom: -5.3023745589999995
  • 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.