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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-19089
  • 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: ['Sc', 'S']
  • Chemical System: S-Sc
  • Density: 2.9234046957233164
  • Atomic Density: 0.047298519752759706
  • Unit Cell Volume: 422.8462138888198
  • Molar Volume: 12.7321970993577
  • Full Formula: Sc8 S12
  • Reduced Formula: Sc2S3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 70
  • Spacegroup Symbol: Fddd1
  • Crystal System: orthorhombic
  • Pointgroup: mmm