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  1. Third-Parties
  2. MatprojStructure
  3. mp-647352

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-647352
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 120
  • Number of elements: 3
  • Element list: ['Rb', 'Cr', 'O']
  • Chemical System: Cr-O-Rb
  • Density: 3.033964511646292
  • Atomic Density: 0.05628555046844452
  • Unit Cell Volume: 2131.9859004892533
  • Molar Volume: 10.699265992568028
  • Full Formula: Rb16 Cr24 O80
  • Reduced Formula: Rb2Cr3O10
  • Formula Anonymous: A2B3C10
  • Spacegroup Number: 61
  • Spacegroup Symbol: Pbca
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -861.7592919800001
  • Final energy per atom: -7.181327433166667
  • 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.