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-20216
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 4
  • Element list: ['Mg', 'Pb', 'W', 'O']
  • Chemical System: Mg-O-Pb-W
  • Density: 8.802020997887091
  • Atomic Density: 0.07377029276262971
  • Unit Cell Volume: 542.2236851995124
  • Molar Volume: 8.16336838919348
  • Full Formula: Mg4 Pb8 W4 O24
  • Reduced Formula: MgPb2WO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -292.30796917000004
  • Final energy per atom: -7.307699229250001
  • 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.