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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-23617
  • 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: 40
  • Number of elements: 3
  • Element list: ['Sm', 'In', 'S']
  • Chemical System: In-S-Sm
  • Density: 5.620903938730974
  • Atomic Density: 0.04463986602606679
  • Unit Cell Volume: 896.0600369329646
  • Molar Volume: 13.490499179552778
  • Full Formula: Sm12 In4 S24
  • Reduced Formula: Sm3InS6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 58
  • Spacegroup Symbol: Pnnm
  • Crystal System: orthorhombic
  • Pointgroup: mmm