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  1. Third-Parties
  2. MatprojStructure
  3. mp-1197690

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-1197690
  • 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: 84
  • Number of elements: 4
  • Element list: ['K', 'Pt', 'N', 'O']
  • Chemical System: K-N-O-Pt
  • Density: 3.413260871206431
  • Atomic Density: 0.05810156987887182
  • Unit Cell Volume: 1445.7440681055666
  • Molar Volume: 10.364850334603274
  • Full Formula: K10 Pt8 N18 O48
  • Reduced Formula: K5Pt4(N3O8)3
  • Formula Anonymous: A4B5C9D24
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -502.45801108
  • Final energy per atom: -5.981642989047619
  • 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.