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  1. Third-Parties
  2. MatprojStructure
  3. mp-1198024

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-1198024
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 328
  • Number of elements: 5
  • Element list: ['B', 'P', 'H', 'Pt', 'C']
  • Chemical System: B-C-H-P-Pt
  • Density: 1.615202436826546
  • Atomic Density: 0.09477076963191397
  • Unit Cell Volume: 3460.9827616040197
  • Molar Volume: 6.354428462900284
  • Full Formula: B64 P8 H192 Pt8 C56
  • Reduced Formula: B8PH24PtC7
  • Formula Anonymous: ABC7D8E24
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -1733.3597844799997
  • Final energy per atom: -5.284633489268292
  • 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.