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  1. Third-Parties
  2. MatprojStructure
  3. mp-1201432

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-1201432
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 198
  • Number of elements: 3
  • Element list: ['Sr', 'Ti', 'O']
  • Chemical System: O-Sr-Ti
  • Density: 2.8328911403235133
  • Atomic Density: 0.049803746770834274
  • Unit Cell Volume: 3975.6045044376338
  • Molar Volume: 12.091742389804786
  • Full Formula: Sr30 Ti46 O122
  • Reduced Formula: Sr15Ti23O61
  • Formula Anonymous: A15B23C61
  • Spacegroup Number: 10
  • Spacegroup Symbol: P12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -1709.50005461
  • Final energy per atom: -8.633838659646464
  • 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.