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  1. Third-Parties
  2. MatprojStructure
  3. mp-554199

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-554199
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 4
  • Element list: ['Rb', 'Sn', 'I', 'O']
  • Chemical System: I-O-Rb-Sn
  • Density: 4.434629390729569
  • Atomic Density: 0.056278545067052786
  • Unit Cell Volume: 319.8376926509737
  • Molar Volume: 10.700597808321005
  • Full Formula: Rb2 Sn2 I2 O12
  • Reduced Formula: RbSnIO6
  • Formula Anonymous: ABCD6
  • Spacegroup Number: 182
  • Spacegroup Symbol: P6_322
  • Crystal System: hexagonal
  • Pointgroup: 622

Thermodynamics:

  • Final energy: -99.67011464
  • Final energy per atom: -5.537228591111111
  • 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.