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  1. Third-Parties
  2. MatprojStructure
  3. mp-1173222

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-1173222
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 14
  • Number of elements: 5
  • Element list: ['Sr', 'La', 'Cu', 'Ru', 'O']
  • Chemical System: Cu-La-O-Ru-Sr
  • Density: 5.848596905731839
  • Atomic Density: 0.07101261532560553
  • Unit Cell Volume: 197.14806919598016
  • Molar Volume: 8.480381594717233
  • Full Formula: Sr3 La1 Cu1 Ru1 O8
  • Reduced Formula: Sr3LaCuRuO8
  • Formula Anonymous: ABCD3E8
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -98.745257
  • Final energy per atom: -7.053232642857142
  • 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.