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  1. Third-Parties
  2. MatprojStructure
  3. mp-1229084

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-1229084
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 11
  • Number of elements: 4
  • Element list: ['Ag', 'W', 'Br', 'O']
  • Chemical System: Ag-Br-O-W
  • Density: 5.430397077960874
  • Atomic Density: 0.03644775495655075
  • Unit Cell Volume: 301.8018534505915
  • Molar Volume: 16.52266584643958
  • Full Formula: Ag1 W2 Br6 O2
  • Reduced Formula: AgW2(Br3O)2
  • Formula Anonymous: AB2C2D6
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -60.53244002
  • Final energy per atom: -5.502949092727273
  • 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.