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  1. Third-Parties
  2. MatprojStructure
  3. mp-1228957

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-1228957
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 16
  • Number of elements: 5
  • Element list: ['Cs', 'La', 'Ta', 'Ti', 'O']
  • Chemical System: Cs-La-O-Ta-Ti
  • Density: 5.904584697321753
  • Atomic Density: 0.06713913519022123
  • Unit Cell Volume: 238.31108271901584
  • Molar Volume: 8.969643030011982
  • Full Formula: Cs1 La2 Ta1 Ti2 O10
  • Reduced Formula: CsLa2TaTi2O10
  • Formula Anonymous: ABC2D2E10
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -144.29658595
  • Final energy per atom: -9.018536621875
  • 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.