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  1. Third-Parties
  2. MatprojStructure
  3. mp-1190833

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-1190833
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 24
  • Number of elements: 3
  • Element list: ['Nd', 'Si', 'Ni']
  • Chemical System: Nd-Ni-Si
  • Density: 8.13372791913197
  • Atomic Density: 0.08066788572701526
  • Unit Cell Volume: 297.51616499801884
  • Molar Volume: 7.46535093330606
  • Full Formula: Nd2 Si4 Ni18
  • Reduced Formula: NdSi2Ni9
  • Formula Anonymous: AB2C9
  • Spacegroup Number: 141
  • Spacegroup Symbol: I4_1/amd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -146.45442999
  • Final energy per atom: -6.10226791625
  • 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.