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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29488
  • 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: 24
  • Number of elements: 4
  • Element list: ['Au', 'Se', 'Cl', 'O']
  • Chemical System: Au-Cl-O-Se
  • Density: 5.521632907560738
  • Atomic Density: 0.05551603934499917
  • Unit Cell Volume: 432.3074967732167
  • Molar Volume: 10.847569154881489
  • Full Formula: Au4 Se4 Cl4 O12
  • Reduced Formula: AuSeClO3
  • Formula Anonymous: ABCD3
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1