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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202728

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-1202728
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 34
  • Number of elements: 4
  • Element list: ['K', 'Zr', 'Si', 'O']
  • Chemical System: K-O-Si-Zr
  • Density: 2.666035940864575
  • Atomic Density: 0.06352289559444167
  • Unit Cell Volume: 535.2400844109984
  • Molar Volume: 9.480268025639159
  • Full Formula: K4 Zr2 Si6 O22
  • Reduced Formula: K2ZrSi3O11
  • Formula Anonymous: AB2C3D11
  • Spacegroup Number: 20
  • Spacegroup Symbol: C222_1
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -251.06159262
  • Final energy per atom: -7.384164488823529
  • 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.