Download Simmate

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

learn more

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-1215745
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 4
  • Element list: ['Zn', 'Fe', 'Co', 'O']
  • Chemical System: Co-Fe-O-Zn
  • Density: 5.083036912519325
  • Atomic Density: 0.0894761359236534
  • Unit Cell Volume: 312.93260164801194
  • Molar Volume: 6.730443483990486
  • Full Formula: Zn3 Fe8 Co1 O16
  • Reduced Formula: Zn3Fe8CoO16
  • Formula Anonymous: AB3C8D16
  • Spacegroup Number: 115
  • Spacegroup Symbol: P-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -205.4217212
  • Final energy per atom: -7.336490042857143
  • 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.