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  1. Third-Parties
  2. MatprojStructure
  3. mp-1223684

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-1223684
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 98
  • Number of elements: 6
  • Element list: ['K', 'Na', 'Mg', 'Zn', 'Si', 'O']
  • Chemical System: K-Mg-Na-O-Si-Zn
  • Density: 2.713195520836915
  • Atomic Density: 0.07393807983629604
  • Unit Cell Volume: 1325.4333926033607
  • Molar Volume: 8.14484332475692
  • Full Formula: K2 Na2 Mg6 Zn4 Si24 O60
  • Reduced Formula: KNaMg3Zn2(Si2O5)6
  • Formula Anonymous: ABC2D3E12F30
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -748.82120683
  • Final energy per atom: -7.641032722755103
  • 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.