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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-115716
  • 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: 3
  • Number of elements: 3
  • Element list: ['Pd', 'Se', 'Br']
  • Chemical System: Br-Pd-Se
  • Density: 6.15402060533069
  • Atomic Density: 0.04191023017375616
  • Unit Cell Volume: 71.58156821287456
  • Molar Volume: 14.369142653315741
  • Full Formula: Pd1 Se1 Br1
  • Reduced Formula: PdSeBr
  • Formula Anonymous: ABC
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm