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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-11392
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Na', 'Au', 'S']
  • Chemical System: Au-Na-S
  • Density: 3.9285295296557754
  • Atomic Density: 0.04300624719297674
  • Unit Cell Volume: 279.0292290827853
  • Molar Volume: 14.002944114090157
  • Full Formula: Na6 Au2 S4
  • Reduced Formula: Na3AuS2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m