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  1. Third-Parties
  2. MatprojStructure
  3. mp-1229080

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-1229080
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 3
  • Element list: ['Ce', 'Cu', 'P']
  • Chemical System: Ce-Cu-P
  • Density: 7.094319438488855
  • Atomic Density: 0.06746803123463714
  • Unit Cell Volume: 533.5860457347702
  • Molar Volume: 8.92591743051829
  • Full Formula: Ce5 Cu19 P12
  • Reduced Formula: Ce5Cu19P12
  • Formula Anonymous: A5B12C19
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -191.57225685
  • Final energy per atom: -5.321451579166666
  • 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.