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  1. Third-Parties
  2. MatprojStructure
  3. mp-1221250

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-1221250
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 24
  • Number of elements: 4
  • Element list: ['Na', 'Ag', 'Te', 'S']
  • Chemical System: Ag-Na-S-Te
  • Density: 3.458445591828604
  • Atomic Density: 0.040024975025272226
  • Unit Cell Volume: 599.6256083819197
  • Molar Volume: 15.045957570735652
  • Full Formula: Na6 Ag2 Te4 S12
  • Reduced Formula: Na3Ag(TeS3)2
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -93.92977441
  • Final energy per atom: -3.9137406004166664
  • 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.