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  1. Third-Parties
  2. MatprojStructure
  3. mp-13122

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-13122
  • 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: 5
  • Number of elements: 3
  • Element list: ['Ce', 'Ge', 'Ir']
  • Chemical System: Ce-Ge-Ir
  • Density: 9.201014003416708
  • Atomic Density: 0.050349386084632866
  • Unit Cell Volume: 99.30607677311978
  • Molar Volume: 11.960703453021878
  • Full Formula: Ce1 Ge3 Ir1
  • Reduced Formula: CeGe3Ir
  • Formula Anonymous: ABC3
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm

Thermodynamics:

  • Final energy: -31.91866718
  • Final energy per atom: -6.383733436
  • 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.