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  1. Third-Parties
  2. MatprojStructure
  3. mp-21043

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-21043
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Rb', 'Pb', 'F']
  • Chemical System: F-Pb-Rb
  • Density: 5.052775839610082
  • Atomic Density: 0.04351121867334998
  • Unit Cell Volume: 114.91289263893754
  • Molar Volume: 13.840432292208993
  • Full Formula: Rb1 Pb1 F3
  • Reduced Formula: RbPbF3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -24.15921262
  • Final energy per atom: -4.831842524000001
  • 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.