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  1. Third-Parties
  2. MatprojStructure
  3. mp-1189405

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-1189405
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 19
  • Number of elements: 4
  • Element list: ['Ba', 'Gd', 'Co', 'O']
  • Chemical System: Ba-Co-Gd-O
  • Density: 7.040400918788649
  • Atomic Density: 0.08048590009387334
  • Unit Cell Volume: 236.0661926851744
  • Molar Volume: 7.482230742249487
  • Full Formula: Ba2 Gd2 Co4 O11
  • Reduced Formula: Ba2Gd2Co4O11
  • Formula Anonymous: A2B2C4D11
  • Spacegroup Number: 47
  • Spacegroup Symbol: Pmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -158.00973236000002
  • Final energy per atom: -8.316301703157896
  • 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.