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  1. Third-Parties
  2. MatprojStructure
  3. mp-1236625

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-1236625
  • 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: 21
  • Number of elements: 4
  • Element list: ['Ba', 'Li', 'Rh', 'O']
  • Chemical System: Ba-Li-O-Rh
  • Density: 6.3674110976336555
  • Atomic Density: 0.06942663132686218
  • Unit Cell Volume: 302.4775881913601
  • Molar Volume: 8.674107680160402
  • Full Formula: Ba4 Li1 Rh4 O12
  • Reduced Formula: Ba4Li(RhO3)4
  • Formula Anonymous: AB4C4D12
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1

Thermodynamics:

  • Final energy: -138.48924877
  • Final energy per atom: -6.594726131904761
  • 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.