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  1. Third-Parties
  2. MatprojStructure
  3. mp-30857

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-30857
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 38
  • Number of elements: 2
  • Element list: ['Zn', 'Pt']
  • Chemical System: Pt-Zn
  • Density: 12.364911743725331
  • Atomic Density: 0.06578954536986137
  • Unit Cell Volume: 577.5993706350805
  • Molar Volume: 9.15364398118912
  • Full Formula: Zn24 Pt14
  • Reduced Formula: Zn12Pt7
  • Formula Anonymous: A7B12
  • Spacegroup Number: 55
  • Spacegroup Symbol: Pbam
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -133.75427703
  • Final energy per atom: -3.519849395526316
  • 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.