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  1. Third-Parties
  2. MatprojStructure
  3. mp-31108

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-31108
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 3
  • Element list: ['Pr', 'In', 'Pt']
  • Chemical System: In-Pr-Pt
  • Density: 9.581361320262587
  • Atomic Density: 0.036389081191290674
  • Unit Cell Volume: 1099.2308321753824
  • Molar Volume: 16.549306997730223
  • Full Formula: Pr24 In2 Pt14
  • Reduced Formula: Pr12InPt7
  • Formula Anonymous: AB7C12
  • Spacegroup Number: 140
  • Spacegroup Symbol: I4/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -239.76917611
  • Final energy per atom: -5.994229402749999
  • 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.