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  1. Third-Parties
  2. MatprojStructure
  3. mp-1210712

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-1210712
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 4
  • Element list: ['Rb', 'Al', 'H', 'N']
  • Chemical System: Al-H-N-Rb
  • Density: 2.0881315627227193
  • Atomic Density: 0.04921467583736607
  • Unit Cell Volume: 731.4891216385322
  • Molar Volume: 12.236473485877786
  • Full Formula: Rb8 Al4 H16 N8
  • Reduced Formula: Rb2Al(H2N)2
  • Formula Anonymous: AB2C2D4
  • Spacegroup Number: 85
  • Spacegroup Symbol: P4/n1
  • Crystal System: tetragonal
  • Pointgroup: 4/m

Thermodynamics:

  • Final energy: -147.06830731
  • Final energy per atom: -4.085230758611111
  • 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.