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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111110
  • 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: 10
  • Number of elements: 4
  • Element list: ['Al', 'Ag', 'P', 'Se']
  • Chemical System: Ag-Al-P-Se
  • Density: 4.610942302113258
  • Atomic Density: 0.041409951301540675
  • Unit Cell Volume: 241.48784738193947
  • Molar Volume: 14.542738087634367
  • Full Formula: Al1 Ag1 P2 Se6
  • Reduced Formula: AlAg(PSe3)2
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2