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-109149
  • 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: 8
  • Number of elements: 3
  • Element list: ['Sm', 'Er', 'S']
  • Chemical System: Er-S-Sm
  • Density: 7.010499051442995
  • Atomic Density: 0.04523789836335265
  • Unit Cell Volume: 176.84287487768933
  • Molar Volume: 13.312158561456412
  • Full Formula: Sm3 Er1 S4
  • Reduced Formula: Sm3ErS4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 47
  • Spacegroup Symbol: Pmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm