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  1. Third-Parties
  2. MatprojStructure
  3. mp-1173180

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-1173180
  • 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: 38
  • Number of elements: 5
  • Element list: ['Sr', 'La', 'Ti', 'Cu', 'O']
  • Chemical System: Cu-La-O-Sr-Ti
  • Density: 6.162018456179648
  • Atomic Density: 0.07591122011409453
  • Unit Cell Volume: 500.58476128938537
  • Molar Volume: 7.933136565251783
  • Full Formula: Sr1 La7 Ti4 Cu4 O22
  • Reduced Formula: SrLa7Ti4(Cu2O11)2
  • Formula Anonymous: AB4C4D7E22
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -313.56315521
  • Final energy per atom: -8.251661979210526
  • 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.