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  1. Third-Parties
  2. MatprojStructure
  3. mp-28665

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-28665
  • 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: 8
  • Number of elements: 3
  • Element list: ['Nd', 'Si', 'Ru']
  • Chemical System: Nd-Ru-Si
  • Density: 6.703122750759636
  • Atomic Density: 0.05355810941324448
  • Unit Cell Volume: 149.3704704599163
  • Molar Volume: 11.244124981212975
  • Full Formula: Nd2 Si4 Ru2
  • Reduced Formula: NdSi2Ru
  • Formula Anonymous: ABC2
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -56.22105069
  • Final energy per atom: -7.02763133625
  • 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.