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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-17817
  • 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: 5
  • Number of elements: 3
  • Element list: ['Li', 'Si', 'Pd']
  • Chemical System: Li-Pd-Si
  • Density: 4.0830435759573
  • Atomic Density: 0.062212767472834954
  • Unit Cell Volume: 80.3693550874945
  • Molar Volume: 9.679911382546278
  • Full Formula: Li1 Si3 Pd1
  • Reduced Formula: LiSi3Pd
  • Formula Anonymous: ABC3
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm