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  1. Third-Parties
  2. MatprojStructure
  3. mp-1195090

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-1195090
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 4
  • Element list: ['Cs', 'Y', 'Se', 'O']
  • Chemical System: Cs-O-Se-Y
  • Density: 4.371375985016759
  • Atomic Density: 0.055336364480379964
  • Unit Cell Volume: 722.8519686034376
  • Molar Volume: 10.882790758932504
  • Full Formula: Cs4 Y4 Se8 O24
  • Reduced Formula: CsY(SeO3)2
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3

Thermodynamics:

  • Final energy: -264.22617919000004
  • Final energy per atom: -6.605654479750001
  • 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.