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  1. Third-Parties
  2. MatprojStructure
  3. mp-562862

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-562862
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 44
  • Number of elements: 4
  • Element list: ['Co', 'Bi', 'S', 'O']
  • Chemical System: Bi-Co-O-S
  • Density: 6.481309738006161
  • Atomic Density: 0.06914270711350615
  • Unit Cell Volume: 636.3650171777142
  • Molar Volume: 8.70972660950912
  • Full Formula: Co4 Bi8 S4 O28
  • Reduced Formula: CoBi2SO7
  • Formula Anonymous: ABC2D7
  • Spacegroup Number: 57
  • Spacegroup Symbol: Pbcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -291.48685408
  • Final energy per atom: -6.624701229090909
  • 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.