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  1. Third-Parties
  2. MatprojStructure
  3. mp-1246386

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-1246386
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Sb', 'Pb', 'N']
  • Chemical System: N-Pb-Sb
  • Density: 9.201529925911283
  • Atomic Density: 0.03658261476266361
  • Unit Cell Volume: 273.35388858551596
  • Molar Volume: 16.461755943553346
  • Full Formula: Sb2 Pb6 N2
  • Reduced Formula: SbPb3N
  • Formula Anonymous: ABC3
  • Spacegroup Number: 74
  • Spacegroup Symbol: Imma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -44.315661950000006
  • Final energy per atom: -4.431566195
  • 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.