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  1. Third-Parties
  2. MatprojStructure
  3. mp-759330

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-759330
  • 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: 132
  • Number of elements: 4
  • Element list: ['Rb', 'Ge', 'H', 'N']
  • Chemical System: Ge-H-N-Rb
  • Density: 2.951013262037641
  • Atomic Density: 0.05426217245364357
  • Unit Cell Volume: 2432.633896344055
  • Molar Volume: 11.09823010706905
  • Full Formula: Rb16 Ge36 H60 N20
  • Reduced Formula: Rb4Ge9(H3N)5
  • Formula Anonymous: A4B5C9D15
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -602.23819139
  • Final energy per atom: -4.5624105408333335
  • 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.