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  1. Third-Parties
  2. MatprojStructure
  3. mp-862982

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-862982
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 10
  • Number of elements: 2
  • Element list: ['Ag', 'Br']
  • Chemical System: Ag-Br
  • Density: 5.516716510957557
  • Atomic Density: 0.03647223634278159
  • Unit Cell Volume: 274.18115812849385
  • Molar Volume: 16.511575279896082
  • Full Formula: Ag4 Br6
  • Reduced Formula: Ag2Br3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -27.0858739
  • Final energy per atom: -2.70858739
  • 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.