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  1. Third-Parties
  2. MatprojStructure
  3. mp-1229184

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-1229184
  • 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: 24
  • Number of elements: 4
  • Element list: ['Ag', 'Hg', 'P', 'Br']
  • Chemical System: Ag-Br-Hg-P
  • Density: 6.570153484316474
  • Atomic Density: 0.040199074029371194
  • Unit Cell Volume: 597.0286773885526
  • Molar Volume: 14.980794720793721
  • Full Formula: Ag4 Hg6 P8 Br6
  • Reduced Formula: Ag2Hg3P4Br3
  • Formula Anonymous: A2B3C3D4
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -74.57998504999999
  • Final energy per atom: -3.107499377083333
  • 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.