Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57598
  • 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: 20
  • Number of elements: 4
  • Element list: ['Ba', 'Ho', 'Ru', 'O']
  • Chemical System: Ba-Ho-O-Ru
  • Density: 6.817346301996786
  • Atomic Density: 0.06789089336482598
  • Unit Cell Volume: 294.5903199789373
  • Molar Volume: 8.870321867233004
  • Full Formula: Ba4 Ho1 Ru3 O12
  • Reduced Formula: Ba4Ho(RuO4)3
  • Formula Anonymous: AB3C4D12
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m