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  1. Third-Parties
  2. MatprojStructure
  3. mp-16965

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-16965
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 16
  • Number of elements: 4
  • Element list: ['La', 'Tm', 'Ge', 'Ir']
  • Chemical System: Ge-Ir-La-Tm
  • Density: 10.295312029649262
  • Atomic Density: 0.05046617306162725
  • Unit Cell Volume: 317.0440520715024
  • Molar Volume: 11.93302442934598
  • Full Formula: La2 Tm2 Ge8 Ir4
  • Reduced Formula: LaTm(Ge2Ir)2
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -104.39571322
  • Final energy per atom: -6.52473207625
  • 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.