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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202327

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-1202327
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 44
  • Number of elements: 7
  • Element list: ['Al', 'Cu', 'Sb', 'Pb', 'S', 'Cl', 'O']
  • Chemical System: Al-Cl-Cu-O-Pb-S-Sb
  • Density: 5.82044329016386
  • Atomic Density: 0.0679996450063396
  • Unit Cell Volume: 647.0622015144032
  • Molar Volume: 8.856135586352776
  • Full Formula: Al1 Cu4 Sb1 Pb6 S2 Cl4 O26
  • Reduced Formula: AlCu4SbPb6S2(Cl2O13)2
  • Formula Anonymous: ABC2D4E4F6G26
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -245.99467706
  • Final energy per atom: -5.590788115
  • 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.