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  1. Third-Parties
  2. MatprojStructure
  3. mp-1205239

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-1205239
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 61
  • Number of elements: 4
  • Element list: ['Rb', 'Cu', 'Cl', 'O']
  • Chemical System: Cl-Cu-O-Rb
  • Density: 3.2831101822134374
  • Atomic Density: 0.03793139505847058
  • Unit Cell Volume: 1608.1665308109434
  • Molar Volume: 15.876401990269473
  • Full Formula: Rb11 Cu18 Cl30 O2
  • Reduced Formula: Rb11Cu18(Cl15O)2
  • Formula Anonymous: A2B11C18D30
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -229.20218545
  • Final energy per atom: -3.757412876229508
  • 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.