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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-21088
  • 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: 10
  • Number of elements: 3
  • Element list: ['Ta', 'Ag', 'S']
  • Chemical System: Ag-S-Ta
  • Density: 6.811579507269319
  • Atomic Density: 0.05327157156734687
  • Unit Cell Volume: 187.71738294519474
  • Molar Volume: 11.30460503194786
  • Full Formula: Ta2 Ag2 S6
  • Reduced Formula: TaAgS3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm