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  1. Third-Parties
  2. MatprojStructure
  3. mp-1189006

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-1189006
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 5
  • Element list: ['K', 'Li', 'Mn', 'Si', 'O']
  • Chemical System: K-Li-Mn-O-Si
  • Density: 3.091447587276436
  • Atomic Density: 0.08090005363897738
  • Unit Cell Volume: 247.21862471502817
  • Molar Volume: 7.443926782637574
  • Full Formula: K1 Li1 Mn2 Si4 O12
  • Reduced Formula: KLiMn2(SiO3)4
  • Formula Anonymous: ABC2D4E12
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -158.98778715
  • Final energy per atom: -7.9493893575
  • 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.