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  1. Third-Parties
  2. MatprojStructure
  3. mp-579463

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-579463
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 60
  • Number of elements: 4
  • Element list: ['Cu', 'Pb', 'Se', 'O']
  • Chemical System: Cu-O-Pb-Se
  • Density: 5.253017951622516
  • Atomic Density: 0.06635044239428232
  • Unit Cell Volume: 904.2893737385303
  • Molar Volume: 9.076263160709463
  • Full Formula: Cu8 Pb4 Se12 O36
  • Reduced Formula: Cu2Pb(SeO3)3
  • Formula Anonymous: AB2C3D9
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -340.78406550000005
  • Final energy per atom: -5.679734425000001
  • 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.