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  1. Third-Parties
  2. MatprojStructure
  3. mp-1212344

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-1212344
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 72
  • Number of elements: 5
  • Element list: ['K', 'Yb', 'P', 'H', 'O']
  • Chemical System: H-K-O-P-Yb
  • Density: 2.520565753155305
  • Atomic Density: 0.08590409504463092
  • Unit Cell Volume: 838.1439786146733
  • Molar Volume: 7.0103069671722125
  • Full Formula: K2 Yb2 P8 H24 O36
  • Reduced Formula: KYbP4(H2O3)6
  • Formula Anonymous: ABC4D12E18
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -451.24060484
  • Final energy per atom: -6.267230622777777
  • 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.