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  1. Third-Parties
  2. MatprojStructure
  3. mp-1520915

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-1520915
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 5
  • Element list: ['Sr', 'Ca', 'Gd', 'Bi', 'O']
  • Chemical System: Bi-Ca-Gd-O-Sr
  • Density: 6.357153538248426
  • Atomic Density: 0.06489585359607544
  • Unit Cell Volume: 308.1860996001984
  • Molar Volume: 9.279700360338873
  • Full Formula: Sr2 Ca2 Gd2 Bi2 O12
  • Reduced Formula: SrCaGdBiO6
  • Formula Anonymous: ABCDE6
  • Spacegroup Number: 66
  • Spacegroup Symbol: Cccm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -157.52880188
  • Final energy per atom: -7.876440094
  • 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.