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  1. Third-Parties
  2. MatprojStructure
  3. mp-1102147

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-1102147
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 11
  • Number of elements: 3
  • Element list: ['Sc', 'P', 'Rh']
  • Chemical System: P-Rh-Sc
  • Density: 8.347720866917259
  • Atomic Density: 0.07032861908241313
  • Unit Cell Volume: 156.4085879051582
  • Molar Volume: 8.56285938579724
  • Full Formula: Sc1 P4 Rh6
  • Reduced Formula: Sc(P2Rh3)2
  • Formula Anonymous: AB4C6
  • Spacegroup Number: 174
  • Spacegroup Symbol: P-6
  • Crystal System: hexagonal
  • Pointgroup: -6

Thermodynamics:

  • Final energy: -81.60100849
  • Final energy per atom: -7.418273499090909
  • 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.