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  1. Third-Parties
  2. MatprojStructure
  3. mp-1218170

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-1218170
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 9
  • Number of elements: 5
  • Element list: ['Sr', 'La', 'Tl', 'Cu', 'O']
  • Chemical System: Cu-La-O-Sr-Tl
  • Density: 7.356801903811997
  • Atomic Density: 0.06941109601098802
  • Unit Cell Volume: 129.66226608171218
  • Molar Volume: 8.676049084496048
  • Full Formula: Sr1 La1 Tl1 Cu1 O5
  • Reduced Formula: SrLaTlCuO5
  • Formula Anonymous: ABCDE5
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm

Thermodynamics:

  • Final energy: -58.44592809
  • Final energy per atom: -6.49399201
  • 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.