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-93803
  • 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: 6
  • Number of elements: 2
  • Element list: ['Hg', 'O']
  • Chemical System: Hg-O
  • Density: 10.45398244794889
  • Atomic Density: 0.05813336555332219
  • Unit Cell Volume: 103.21095197037174
  • Molar Volume: 10.359181345652967
  • Full Formula: Hg3 O3
  • Reduced Formula: HgO
  • Formula Anonymous: AB
  • Spacegroup Number: 154
  • Spacegroup Symbol: P3_221
  • Crystal System: trigonal
  • Pointgroup: 321