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-39434
  • 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: 24
  • Number of elements: 3
  • Element list: ['K', 'H', 'N']
  • Chemical System: H-K-N
  • Density: 1.3454941916625458
  • Atomic Density: 0.10902777715601199
  • Unit Cell Volume: 220.12738979037871
  • Molar Volume: 5.523492193537699
  • Full Formula: K2 H16 N6
  • Reduced Formula: KH8N3
  • Formula Anonymous: AB3C8
  • Spacegroup Number: 20
  • Spacegroup Symbol: C222_1
  • Crystal System: orthorhombic
  • Pointgroup: 222