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  1. Third-Parties
  2. MatprojStructure
  3. mp-1209348

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-1209348
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 3
  • Element list: ['Rb', 'Tm', 'I']
  • Chemical System: I-Rb-Tm
  • Density: 4.505465231177458
  • Atomic Density: 0.022085956901995187
  • Unit Cell Volume: 905.5527948709006
  • Molar Volume: 27.266831981619845
  • Full Formula: Rb5 Tm3 I12
  • Reduced Formula: Rb5(TmI4)3
  • Formula Anonymous: A3B5C12
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m

Thermodynamics:

  • Final energy: -68.02078539
  • Final energy per atom: -3.4010392695
  • 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.