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  1. Third-Parties
  2. MatprojStructure
  3. mp-22075

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-22075
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 2
  • Element list: ['In', 'Pt']
  • Chemical System: In-Pt
  • Density: 10.418048687045193
  • Atomic Density: 0.045169150022246994
  • Unit Cell Volume: 442.78008309099187
  • Molar Volume: 13.332419930492243
  • Full Formula: In14 Pt6
  • Reduced Formula: In7Pt3
  • Formula Anonymous: A3B7
  • Spacegroup Number: 229
  • Spacegroup Symbol: Im-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -83.56112396
  • Final energy per atom: -4.178056198
  • 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.