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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200130

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-1200130
  • 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: 42
  • Number of elements: 2
  • Element list: ['Rb', 'Tl']
  • Chemical System: Rb-Tl
  • Density: 6.384648809130687
  • Atomic Density: 0.023746790066076322
  • Unit Cell Volume: 1768.660096085974
  • Molar Volume: 25.35980965529729
  • Full Formula: Rb15 Tl27
  • Reduced Formula: Rb5Tl9
  • Formula Anonymous: A5B9
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m

Thermodynamics:

  • Final energy: -83.47243608
  • Final energy per atom: -1.987438954285714
  • 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.