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  1. Third-Parties
  2. MatprojStructure
  3. mp-1201961

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-1201961
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 62
  • Number of elements: 4
  • Element list: ['Cs', 'Ho', 'Te', 'Cl']
  • Chemical System: Cl-Cs-Ho-Te
  • Density: 6.118583948115217
  • Atomic Density: 0.02645696994650898
  • Unit Cell Volume: 2343.427842468444
  • Molar Volume: 22.762019884271087
  • Full Formula: Cs6 Ho21 Te34 Cl1
  • Reduced Formula: Cs6Ho21Te34Cl
  • Formula Anonymous: AB6C21D34
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -313.94925295
  • Final energy per atom: -5.063697628225807
  • 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.