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  1. Third-Parties
  2. MatprojStructure
  3. mp-768439

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-768439
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 46
  • Number of elements: 4
  • Element list: ['Li', 'Co', 'B', 'O']
  • Chemical System: B-Co-Li-O
  • Density: 3.463885267139042
  • Atomic Density: 0.09755741073511857
  • Unit Cell Volume: 471.517229223069
  • Molar Volume: 6.172919837275016
  • Full Formula: Li6 Co8 B8 O24
  • Reduced Formula: Li3Co4(BO3)4
  • Formula Anonymous: A3B4C4D12
  • Spacegroup Number: 7
  • Spacegroup Symbol: P1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -340.91864272
  • Final energy per atom: -7.41127484173913
  • 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.