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  1. Third-Parties
  2. MatprojStructure
  3. mp-1204157

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-1204157
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 4
  • Element list: ['Ag', 'S', 'N', 'O']
  • Chemical System: Ag-N-O-S
  • Density: 3.8130803971741045
  • Atomic Density: 0.0682275614822007
  • Unit Cell Volume: 527.6460013801275
  • Molar Volume: 8.826551366006338
  • Full Formula: Ag6 S6 N6 O18
  • Reduced Formula: AgSNO3
  • Formula Anonymous: ABCD3
  • Spacegroup Number: 159
  • Spacegroup Symbol: P31c
  • Crystal System: trigonal
  • Pointgroup: 31m

Thermodynamics:

  • Final energy: -192.29922103
  • Final energy per atom: -5.3416450286111115
  • 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.