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  1. Third-Parties
  2. MatprojStructure
  3. mp-1209789

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-1209789
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 29
  • Number of elements: 3
  • Element list: ['Sm', 'Rh', 'Pb']
  • Chemical System: Pb-Rh-Sm
  • Density: 10.269571290854335
  • Atomic Density: 0.03478690973055907
  • Unit Cell Volume: 833.6469155960848
  • Molar Volume: 17.311514033998147
  • Full Formula: Sm4 Rh6 Pb19
  • Reduced Formula: Sm4Rh6Pb19
  • Formula Anonymous: A4B6C19
  • Spacegroup Number: 197
  • Spacegroup Symbol: I23
  • Crystal System: cubic
  • Pointgroup: 23

Thermodynamics:

  • Final energy: -133.72614936
  • Final energy per atom: -4.611246529655173
  • 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.