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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119477
  • 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: 14
  • Number of elements: 4
  • Element list: ['Ti', 'Fe', 'Co', 'S']
  • Chemical System: Co-Fe-S-Ti
  • Density: 4.28166615214715
  • Atomic Density: 0.0641451371652765
  • Unit Cell Volume: 218.25504814071203
  • Molar Volume: 9.388304439171032
  • Full Formula: Ti4 Fe1 Co1 S8
  • Reduced Formula: Ti4FeCoS8
  • Formula Anonymous: ABC4D8
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1