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  1. Third-Parties
  2. MatprojStructure
  3. mp-1215020

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-1215020
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 100
  • Number of elements: 3
  • Element list: ['Al', 'Zn', 'Pd']
  • Chemical System: Al-Pd-Zn
  • Density: 7.846326531561475
  • Atomic Density: 0.06631453868114759
  • Unit Cell Volume: 1507.9649499006284
  • Molar Volume: 9.081177189447935
  • Full Formula: Al4 Zn78 Pd18
  • Reduced Formula: Al2(Zn13Pd3)3
  • Formula Anonymous: A2B9C39
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -236.67232345
  • Final energy per atom: -2.3667232344999998
  • 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.