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  1. Third-Parties
  2. MatprojStructure
  3. mp-1224604

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-1224604
  • 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: 80
  • Number of elements: 8
  • Element list: ['K', 'Na', 'Li', 'Ti', 'Mn', 'Fe', 'Si', 'O']
  • Chemical System: Fe-K-Li-Mn-Na-O-Si-Ti
  • Density: 3.075605519502979
  • Atomic Density: 0.08170582140782158
  • Unit Cell Volume: 979.1224006021891
  • Molar Volume: 7.370516147119365
  • Full Formula: K2 Na4 Li2 Ti4 Mn3 Fe1 Si16 O48
  • Reduced Formula: K2Na4Li2Ti4Mn3Fe(SiO3)16
  • Formula Anonymous: AB2C2D3E4F4G16H48
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -646.02792316
  • Final energy per atom: -8.0753490395
  • 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.