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  1. Third-Parties
  2. MatprojStructure
  3. mp-978253

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-978253
  • 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: 28
  • Number of elements: 3
  • Element list: ['Ce', 'Si', 'Rh']
  • Chemical System: Ce-Rh-Si
  • Density: 7.798114754403979
  • Atomic Density: 0.04817748202617165
  • Unit Cell Volume: 581.1843795570189
  • Molar Volume: 12.499907647162983
  • Full Formula: Ce12 Si8 Rh8
  • Reduced Formula: Ce3(SiRh)2
  • Formula Anonymous: A2B2C3
  • Spacegroup Number: 57
  • Spacegroup Symbol: Pbcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -196.93129823
  • Final energy per atom: -7.033260651071429
  • 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.