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-116164
  • 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: 2
  • Number of elements: 2
  • Element list: ['Hg', 'Cl']
  • Chemical System: Cl-Hg
  • Density: 6.308551365412486
  • Atomic Density: 0.0321898843239012
  • Unit Cell Volume: 62.13131988532767
  • Molar Volume: 18.708177697701515
  • Full Formula: Hg1 Cl1
  • Reduced Formula: HgCl
  • Formula Anonymous: AB
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm