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-531125
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 76
  • Number of elements: 3
  • Element list: ['Ag', 'Pb', 'O']
  • Chemical System: Ag-O-Pb
  • Density: 8.221748392782349
  • Atomic Density: 0.06186330757081352
  • Unit Cell Volume: 1228.5149789801414
  • Molar Volume: 9.73459227524586
  • Full Formula: Ag28 Pb12 O36
  • Reduced Formula: Ag7(PbO3)3
  • Formula Anonymous: A3B7C9
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -364.03631203
  • Final energy per atom: -4.789951474078947
  • 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.