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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100560
  • 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: 6
  • Number of elements: 3
  • Element list: ['Hf', 'Al', 'Si']
  • Chemical System: Al-Hf-Si
  • Density: 10.941837458132637
  • Atomic Density: 0.05141037861709846
  • Unit Cell Volume: 116.70795200104739
  • Molar Volume: 11.713861912693853
  • Full Formula: Hf4 Al1 Si1
  • Reduced Formula: Hf4AlSi
  • Formula Anonymous: ABC4
  • Spacegroup Number: 97
  • Spacegroup Symbol: I422
  • Crystal System: tetragonal
  • Pointgroup: 422