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  1. Third-Parties
  2. MatprojStructure
  3. mp-1225783

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-1225783
  • 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: 16
  • Number of elements: 4
  • Element list: ['Cu', 'Ag', 'P', 'S']
  • Chemical System: Ag-Cu-P-S
  • Density: 4.402121887998341
  • Atomic Density: 0.05093767330992953
  • Unit Cell Volume: 314.10936072105676
  • Molar Volume: 11.822567401848868
  • Full Formula: Cu3 Ag3 P2 S8
  • Reduced Formula: Cu3Ag3(PS4)2
  • Formula Anonymous: A2B3C3D8
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -72.20561301000001
  • Final energy per atom: -4.5128508131250005
  • 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.