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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-62285
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 34
  • Number of elements: 6
  • Element list: ['Na', 'H', 'Au', 'C', 'S', 'O']
  • Chemical System: Au-C-H-Na-O-S
  • Density: 2.458430830998227
  • Atomic Density: 0.08384657183187229
  • Unit Cell Volume: 405.50256566453567
  • Molar Volume: 7.18233390874405
  • Full Formula: Na1 H12 Au1 C4 S4 O12
  • Reduced Formula: NaH12AuC4(SO3)4
  • Formula Anonymous: ABC4D4E12F12
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1