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  1. Third-Parties
  2. MatprojStructure
  3. mp-567558

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-567558
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Cs', 'Ag', 'Cl']
  • Chemical System: Ag-Cl-Cs
  • Density: 3.9222483110410384
  • Atomic Density: 0.03031360088980397
  • Unit Cell Volume: 263.9079411608541
  • Molar Volume: 19.866134616905768
  • Full Formula: Cs2 Ag2 Cl4
  • Reduced Formula: CsAgCl2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -27.07787036
  • Final energy per atom: -3.384733795
  • 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.