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  1. Third-Parties
  2. MatprojStructure
  3. mp-961732

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-961732
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['Hf', 'Ni', 'Pb']
  • Chemical System: Hf-Ni-Pb
  • Density: 12.009064382285194
  • Atomic Density: 0.04882289221268138
  • Unit Cell Volume: 61.44658507594052
  • Molar Volume: 12.334666151620969
  • Full Formula: Hf1 Ni1 Pb1
  • Reduced Formula: HfNiPb
  • Formula Anonymous: ABC
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -17.98529143
  • Final energy per atom: -5.995097143333333
  • 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.