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  1. Third-Parties
  2. MatprojStructure
  3. mp-643629

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-643629
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 32
  • Number of elements: 5
  • Element list: ['Sr', 'Y', 'Cu', 'Pb', 'O']
  • Chemical System: Cu-O-Pb-Sr-Y
  • Density: 6.958368163595977
  • Atomic Density: 0.06723650691307068
  • Unit Cell Volume: 475.93192253982556
  • Molar Volume: 8.956653217850771
  • Full Formula: Sr4 Y2 Cu6 Pb4 O16
  • Reduced Formula: Sr2YCu3(PbO4)2
  • Formula Anonymous: AB2C2D3E8
  • Spacegroup Number: 17
  • Spacegroup Symbol: P222_1
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -204.36740217
  • Final energy per atom: -6.3864813178125
  • 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.