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  1. Third-Parties
  2. MatprojStructure
  3. mp-1218732

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-1218732
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 54
  • Number of elements: 6
  • Element list: ['Sr', 'Cu', 'Hg', 'Bi', 'Sb', 'O']
  • Chemical System: Bi-Cu-Hg-O-Sb-Sr
  • Density: 6.099561279347179
  • Atomic Density: 0.06560430084043765
  • Unit Cell Volume: 823.1167668616489
  • Molar Volume: 9.179490799920284
  • Full Formula: Sr14 Cu4 Hg2 Bi2 Sb2 O30
  • Reduced Formula: Sr7Cu2HgBiSbO15
  • Formula Anonymous: ABCD2E7F15
  • Spacegroup Number: 51
  • Spacegroup Symbol: Pmma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -331.15947573
  • Final energy per atom: -6.1325828838888885
  • 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.