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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-81505
  • 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: 4
  • Number of elements: 3
  • Element list: ['In', 'Cu', 'S']
  • Chemical System: Cu-In-S
  • Density: 5.014265358526267
  • Atomic Density: 0.0498100766327783
  • Unit Cell Volume: 80.30503605705633
  • Molar Volume: 12.090205771811714
  • Full Formula: In1 Cu1 S2
  • Reduced Formula: InCuS2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m