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-114140
  • 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: 3
  • Number of elements: 3
  • Element list: ['Sn', 'C', 'I']
  • Chemical System: C-I-Sn
  • Density: 5.430638413267321
  • Atomic Density: 0.03808331571716461
  • Unit Cell Volume: 78.77465350654496
  • Molar Volume: 15.813068391221378
  • Full Formula: Sn1 C1 I1
  • Reduced Formula: SnCI
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2