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  1. Third-Parties
  2. MatprojStructure
  3. mp-21613

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-21613
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 29
  • Number of elements: 2
  • Element list: ['K', 'Pb']
  • Chemical System: K-Pb
  • Density: 8.636371505610052
  • Atomic Density: 0.02918322044203382
  • Unit Cell Volume: 993.7217195614944
  • Molar Volume: 20.635627832650222
  • Full Formula: K5 Pb24
  • Reduced Formula: K5Pb24
  • Formula Anonymous: A5B24
  • Spacegroup Number: 217
  • Spacegroup Symbol: I-43m
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -97.24585085
  • Final energy per atom: -3.3533052017241376
  • 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.