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  1. Third-Parties
  2. MatprojStructure
  3. mp-1190466

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-1190466
  • 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: 50
  • Number of elements: 4
  • Element list: ['Co', 'Bi', 'S', 'O']
  • Chemical System: Bi-Co-O-S
  • Density: 7.173538294349684
  • Atomic Density: 0.06613862622759002
  • Unit Cell Volume: 755.9878826019867
  • Molar Volume: 9.105330883767039
  • Full Formula: Co2 Bi12 S4 O32
  • Reduced Formula: CoBi6(SO8)2
  • Formula Anonymous: AB2C6D16
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -324.60956219
  • Final energy per atom: -6.492191243800001
  • 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.