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  1. Third-Parties
  2. MatprojStructure
  3. mp-1192853

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-1192853
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 30
  • Number of elements: 4
  • Element list: ['Cs', 'Mn', 'As', 'S']
  • Chemical System: As-Cs-Mn-S
  • Density: 3.264074837670794
  • Atomic Density: 0.02969522876765055
  • Unit Cell Volume: 1010.263306429936
  • Molar Volume: 20.27982611994696
  • Full Formula: Cs8 Mn2 As4 S16
  • Reduced Formula: Cs4Mn(AsS4)2
  • Formula Anonymous: AB2C4D8
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -140.17270007
  • Final energy per atom: -4.672423335666666
  • 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.