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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97355
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 40
  • Number of elements: 3
  • Element list: ['Sc', 'U', 'S']
  • Chemical System: S-Sc-U
  • Density: 7.627226390852902
  • Atomic Density: 0.048276913070191003
  • Unit Cell Volume: 828.5533903512639
  • Molar Volume: 12.474162859676344
  • Full Formula: Sc4 U12 S24
  • Reduced Formula: Sc(US2)3
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 58
  • Spacegroup Symbol: Pnnm
  • Crystal System: orthorhombic
  • Pointgroup: mmm