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  1. Third-Parties
  2. MatprojStructure
  3. mp-1218472

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-1218472
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 13
  • Number of elements: 5
  • Element list: ['Sr', 'Y', 'Fe', 'Cu', 'O']
  • Chemical System: Cu-Fe-O-Sr-Y
  • Density: 5.47718071955504
  • Atomic Density: 0.07669700721762919
  • Unit Cell Volume: 169.498139127023
  • Molar Volume: 7.851858864469199
  • Full Formula: Sr2 Y1 Fe1 Cu2 O7
  • Reduced Formula: Sr2YFeCu2O7
  • Formula Anonymous: ABC2D2E7
  • Spacegroup Number: 47
  • Spacegroup Symbol: Pmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -91.00399752
  • Final energy per atom: -7.000307501538462
  • 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.