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  1. Third-Parties
  2. MatprojStructure
  3. mp-1263047

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-1263047
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 5
  • Element list: ['Rb', 'Al', 'H', 'N', 'F']
  • Chemical System: Al-F-H-N-Rb
  • Density: 2.213220468514512
  • Atomic Density: 0.09406122955296321
  • Unit Cell Volume: 595.3568783455886
  • Molar Volume: 6.402362363984519
  • Full Formula: Rb1 Al6 H20 N5 F24
  • Reduced Formula: RbAl6H20N5F24
  • Formula Anonymous: AB5C6D20E24
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -293.99384469999995
  • Final energy per atom: -5.2498900839285705
  • 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.