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  1. Third-Parties
  2. MatprojStructure
  3. mp-1193078

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-1193078
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 29
  • Number of elements: 3
  • Element list: ['Hf', 'Ga', 'Ni']
  • Chemical System: Ga-Hf-Ni
  • Density: 9.871669837338198
  • Atomic Density: 0.06637538806492002
  • Unit Cell Volume: 436.9089333479431
  • Molar Volume: 9.07285205490611
  • Full Formula: Hf6 Ga16 Ni7
  • Reduced Formula: Hf6Ga16Ni7
  • Formula Anonymous: A6B7C16
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -161.97818189
  • Final energy per atom: -5.585454547931034
  • 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.