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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-140
  • 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: 12
  • Number of elements: 2
  • Element list: ['Pd', 'Se']
  • Chemical System: Pd-Se
  • Density: 6.626667885497319
  • Atomic Density: 0.04529022485060226
  • Unit Cell Volume: 264.9578366984068
  • Molar Volume: 13.296778233857497
  • Full Formula: Pd4 Se8
  • Reduced Formula: PdSe2
  • Formula Anonymous: AB2
  • Spacegroup Number: 61
  • Spacegroup Symbol: Pbca
  • Crystal System: orthorhombic
  • Pointgroup: mmm