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  1. Third-Parties
  2. MatprojStructure
  3. mp-1196871

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-1196871
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 218
  • Number of elements: 7
  • Element list: ['K', 'Cu', 'Ag', 'H', 'Pb', 'Cl', 'O']
  • Chemical System: Ag-Cl-Cu-H-K-O-Pb
  • Density: 4.88288013812943
  • Atomic Density: 0.058613677495429624
  • Unit Cell Volume: 3719.2684253090665
  • Molar Volume: 10.274292652034287
  • Full Formula: K1 Cu24 Ag9 H48 Pb26 Cl62 O48
  • Reduced Formula: KCu24Ag9H48Pb26(Cl31O24)2
  • Formula Anonymous: AB9C24D26E48F48G62
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -1006.87757506
  • Final energy per atom: -4.6187044727522935
  • 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.