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  1. Third-Parties
  2. MatprojStructure
  3. mp-14338

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-14338
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Cs', 'Pt', 'Se']
  • Chemical System: Cs-Pt-Se
  • Density: 6.809662544715589
  • Atomic Density: 0.031628914134761404
  • Unit Cell Volume: 284.5497623362495
  • Molar Volume: 19.039985800149346
  • Full Formula: Cs2 Pt3 Se4
  • Reduced Formula: Cs2Pt3Se4
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 69
  • Spacegroup Symbol: Fmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -42.23530654
  • Final energy per atom: -4.6928118377777785
  • 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.