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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104762
  • 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: 8
  • Number of elements: 3
  • Element list: ['Al', 'Si', 'Ni']
  • Chemical System: Al-Ni-Si
  • Density: 7.7194942677580665
  • Atomic Density: 0.09132563611594992
  • Unit Cell Volume: 87.59862334649327
  • Molar Volume: 6.594140502185058
  • Full Formula: Al1 Si1 Ni6
  • Reduced Formula: AlSiNi6
  • Formula Anonymous: ABC6
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm