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-95439
  • 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: 24
  • Number of elements: 4
  • Element list: ['K', 'S', 'N', 'O']
  • Chemical System: K-N-O-S
  • Density: 2.537981963040508
  • Atomic Density: 0.06835226428912665
  • Unit Cell Volume: 351.122237860054
  • Molar Volume: 8.810448084831027
  • Full Formula: K4 S4 N2 O14
  • Reduced Formula: K2S2NO7
  • Formula Anonymous: AB2C2D7
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1