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-8723
  • 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: 3
  • Number of elements: 2
  • Element list: ['Y', 'Hg']
  • Chemical System: Hg-Y
  • Density: 11.290795008832506
  • Atomic Density: 0.04162215060422107
  • Unit Cell Volume: 72.07700602802964
  • Molar Volume: 14.468595862005435
  • Full Formula: Y1 Hg2
  • Reduced Formula: YHg2
  • Formula Anonymous: AB2
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm