Download Simmate

You can install Simmate to host your own server and access advanced features

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-1218676

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-1218676
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 25
  • Number of elements: 5
  • Element list: ['Sr', 'La', 'Fe', 'Co', 'O']
  • Chemical System: Co-Fe-La-O-Sr
  • Density: 5.683134848155879
  • Atomic Density: 0.08405977843883208
  • Unit Cell Volume: 297.40739821473346
  • Molar Volume: 7.164116860457991
  • Full Formula: Sr4 La1 Fe2 Co3 O15
  • Reduced Formula: Sr4LaFe2(CoO5)3
  • Formula Anonymous: AB2C3D4E15
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -179.36583117
  • Final energy per atom: -7.1746332468
  • 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.