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-1521539
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 4
  • Element list: ['Ce', 'Eu', 'Zr', 'O']
  • Chemical System: Ce-Eu-O-Zr
  • Density: 6.559615875963368
  • Atomic Density: 0.06257747173804426
  • Unit Cell Volume: 639.2076715314438
  • Molar Volume: 9.623496432085497
  • Full Formula: Ce4 Eu8 Zr4 O24
  • Reduced Formula: CeEu2ZrO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 201
  • Spacegroup Symbol: Pn-31
  • Crystal System: cubic
  • Pointgroup: m-3

Thermodynamics:

  • Final energy: -401.42852269
  • Final energy per atom: -10.03571306725
  • 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.