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  1. Third-Parties
  2. MatprojStructure
  3. mp-1225875

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-1225875
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 111
  • Number of elements: 5
  • Element list: ['K', 'Mo', 'H', 'Pt', 'O']
  • Chemical System: H-K-Mo-O-Pt
  • Density: 3.297865507154331
  • Atomic Density: 0.07900391849254815
  • Unit Cell Volume: 1404.993601810647
  • Molar Volume: 7.622584898200998
  • Full Formula: K7 Mo12 H31 Pt2 O59
  • Reduced Formula: K7Mo12H31Pt2O59
  • Formula Anonymous: A2B7C12D31E59
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -731.99651177
  • Final energy per atom: -6.594563169099099
  • 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.