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  1. Third-Parties
  2. MatprojStructure
  3. mp-1203892

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-1203892
  • 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: 68
  • Number of elements: 3
  • Element list: ['Cs', 'Ti', 'Te']
  • Chemical System: Cs-Te-Ti
  • Density: 4.756958837827176
  • Atomic Density: 0.025026771349123976
  • Unit Cell Volume: 2717.090392979526
  • Molar Volume: 24.062795300244737
  • Full Formula: Cs12 Ti12 Te44
  • Reduced Formula: Cs3Ti3Te11
  • Formula Anonymous: A3B3C11
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -312.93104716000005
  • Final energy per atom: -4.601927164117647
  • 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.