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  1. Third-Parties
  2. MatprojStructure
  3. mp-1349934

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-1349934
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 41
  • Number of elements: 3
  • Element list: ['Ho', 'Pb', 'S']
  • Chemical System: Ho-Pb-S
  • Density: 6.911553998302722
  • Atomic Density: 0.04611976518431987
  • Unit Cell Volume: 888.989782062886
  • Molar Volume: 13.057613662888835
  • Full Formula: Ho14 Pb3 S24
  • Reduced Formula: Ho14(PbS8)3
  • Formula Anonymous: A3B14C24
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -259.60874524
  • Final energy per atom: -6.331920615609756
  • 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.