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-10973
  • 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: 14
  • Number of elements: 5
  • Element list: ['Co', 'Hg', 'C', 'Se', 'N']
  • Chemical System: C-Co-Hg-N-Se
  • Density: 3.8578147576220445
  • Atomic Density: 0.04787114361503164
  • Unit Cell Volume: 292.45175575049285
  • Molar Volume: 12.579897418847194
  • Full Formula: Co1 Hg1 C4 Se4 N4
  • Reduced Formula: CoHgC4(SeN)4
  • Formula Anonymous: ABC4D4E4
  • Spacegroup Number: 82
  • Spacegroup Symbol: I-4
  • Crystal System: tetragonal
  • Pointgroup: -4