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  1. Third-Parties
  2. MatprojStructure
  3. mp-1229197

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-1229197
  • 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: 48
  • Number of elements: 4
  • Element list: ['Al', 'Si', 'Pb', 'O']
  • Chemical System: Al-O-Pb-Si
  • Density: 3.622277770149141
  • Atomic Density: 0.06265415442466021
  • Unit Cell Volume: 766.1104110457447
  • Molar Volume: 9.611718193789446
  • Full Formula: Al6 Si6 Pb4 O32
  • Reduced Formula: Al3Si3(PbO8)2
  • Formula Anonymous: A2B3C3D16
  • Spacegroup Number: 37
  • Spacegroup Symbol: Ccc2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -341.28239301
  • Final energy per atom: -7.110049854375
  • 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.