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  1. Third-Parties
  2. MatprojStructure
  3. mp-1223691

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-1223691
  • 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: 20
  • Number of elements: 6
  • Element list: ['La', 'Zn', 'Cu', 'Rh', 'Pb', 'O']
  • Chemical System: Cu-La-O-Pb-Rh-Zn
  • Density: 7.491193542495406
  • Atomic Density: 0.07841139114989792
  • Unit Cell Volume: 255.06498107865843
  • Molar Volume: 7.68018609501209
  • Full Formula: La3 Zn1 Cu1 Rh2 Pb1 O12
  • Reduced Formula: La3ZnCuRh2PbO12
  • Formula Anonymous: ABCD2E3F12
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -142.97915657
  • Final energy per atom: -7.1489578284999995
  • 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.