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-18993
  • 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: 20
  • Number of elements: 2
  • Element list: ['Sb', 'Se']
  • Chemical System: Sb-Se
  • Density: 5.644924248228103
  • Atomic Density: 0.03538148252926166
  • Unit Cell Volume: 565.2674385099419
  • Molar Volume: 17.020600408757574
  • Full Formula: Sb8 Se12
  • Reduced Formula: Sb2Se3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm