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  1. Third-Parties
  2. MatprojStructure
  3. mp-13726

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-13726
  • 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: 116
  • Number of elements: 6
  • Element list: ['Na', 'Sr', 'La', 'Zn', 'Si', 'O']
  • Chemical System: La-Na-O-Si-Sr-Zn
  • Density: 3.457913676807991
  • Atomic Density: 0.0753546652772297
  • Unit Cell Volume: 1539.3871046103936
  • Molar Volume: 7.991729162148824
  • Full Formula: Na12 Sr4 La4 Zn4 Si24 O68
  • Reduced Formula: Na3SrLaZnSi6O17
  • Formula Anonymous: ABCD3E6F17
  • Spacegroup Number: 54
  • Spacegroup Symbol: Pcca
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -875.94114247
  • Final energy per atom: -7.551216745431035
  • 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.