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  1. Third-Parties
  2. MatprojStructure
  3. mp-680664

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-680664
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 35
  • Number of elements: 3
  • Element list: ['U', 'Ga', 'Ni']
  • Chemical System: Ga-Ni-U
  • Density: 9.219110748857998
  • Atomic Density: 0.06494069306471026
  • Unit Cell Volume: 538.9532871958141
  • Molar Volume: 9.273293024451137
  • Full Formula: U4 Ga20 Ni11
  • Reduced Formula: U4Ga20Ni11
  • Formula Anonymous: A4B11C20
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -181.76036865
  • Final energy per atom: -5.19315339
  • 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.