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  1. Third-Parties
  2. MatprojStructure
  3. mp-840

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-840
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 6
  • Number of elements: 2
  • Element list: ['Sm', 'Rh']
  • Chemical System: Rh-Sm
  • Density: 10.636837257717147
  • Atomic Density: 0.05395430669200043
  • Unit Cell Volume: 111.20520988715798
  • Molar Volume: 11.161557119763486
  • Full Formula: Sm2 Rh4
  • Reduced Formula: SmRh2
  • Formula Anonymous: AB2
  • Spacegroup Number: 227
  • Spacegroup Symbol: Fd-3m1
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -43.03917762
  • Final energy per atom: -7.173196269999999
  • 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.