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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35327
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Th', 'Si', 'Ru']
  • Chemical System: Ru-Si-Th
  • Density: 9.778795686069941
  • Atomic Density: 0.059743712796619886
  • Unit Cell Volume: 100.42897769720568
  • Molar Volume: 10.079957334591223
  • Full Formula: Th1 Si2 Ru3
  • Reduced Formula: ThSi2Ru3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm