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-113112
  • 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: 19
  • Number of elements: 3
  • Element list: ['Cd', 'Sb', 'S']
  • Chemical System: Cd-S-Sb
  • Density: 4.52893013870578
  • Atomic Density: 0.03961504698362874
  • Unit Cell Volume: 479.61573812728057
  • Molar Volume: 15.20164992480938
  • Full Formula: Cd2 Sb6 S11
  • Reduced Formula: Cd2Sb6S11
  • Formula Anonymous: A2B6C11
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m