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  1. Third-Parties
  2. MatprojStructure
  3. mp-1080610

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-1080610
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 9
  • Number of elements: 4
  • Element list: ['Cs', 'Mn', 'Cl', 'O']
  • Chemical System: Cl-Cs-Mn-O
  • Density: 3.019195343069925
  • Atomic Density: 0.03308764502059333
  • Unit Cell Volume: 272.00485239727743
  • Molar Volume: 18.200572317104758
  • Full Formula: Cs2 Mn1 Cl4 O2
  • Reduced Formula: Cs2Mn(Cl2O)2
  • Formula Anonymous: AB2C2D4
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -41.45173619
  • Final energy per atom: -4.605748465555555
  • 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.