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  1. Third-Parties
  2. MatprojStructure
  3. mp-1211234

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-1211234
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 160
  • Number of elements: 5
  • Element list: ['Rb', 'Cd', 'H', 'S', 'O']
  • Chemical System: Cd-H-O-Rb-S
  • Density: 3.2540292313587247
  • Atomic Density: 0.07978143032595933
  • Unit Cell Volume: 2005.4792117200125
  • Molar Volume: 7.5482988151448485
  • Full Formula: Rb8 Cd12 H40 S16 O84
  • Reduced Formula: Rb2Cd3H10S4O21
  • Formula Anonymous: A2B3C4D10E21
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -908.88993068
  • Final energy per atom: -5.68056206675
  • 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.