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-88170
  • 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: 28
  • Number of elements: 2
  • Element list: ['Hg', 'N']
  • Chemical System: Hg-N
  • Density: 4.5179761074592655
  • Atomic Density: 0.06691321460332507
  • Unit Cell Volume: 418.4524710999106
  • Molar Volume: 8.999927436905335
  • Full Formula: Hg4 N24
  • Reduced Formula: HgN6
  • Formula Anonymous: AB6
  • Spacegroup Number: 29
  • Spacegroup Symbol: Pca2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2