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  1. Third-Parties
  2. MatprojStructure
  3. mp-559919

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-559919
  • 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: 38
  • Number of elements: 4
  • Element list: ['Cs', 'Mo', 'P', 'O']
  • Chemical System: Cs-Mo-O-P
  • Density: 3.4098661756275486
  • Atomic Density: 0.06235573757081142
  • Unit Cell Volume: 609.4066316968355
  • Molar Volume: 9.657717147778477
  • Full Formula: Cs2 Mo4 P6 O26
  • Reduced Formula: CsMo2P3O13
  • Formula Anonymous: AB2C3D13
  • Spacegroup Number: 13
  • Spacegroup Symbol: P12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -300.00590232
  • Final energy per atom: -7.89489216631579
  • 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.