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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-86640
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Ba', 'Al', 'Si']
  • Chemical System: Al-Ba-Si
  • Density: 3.3660826340932863
  • Atomic Density: 0.04095800371652666
  • Unit Cell Volume: 244.15252435667352
  • Molar Volume: 14.703208685852166
  • Full Formula: Ba2 Al4 Si4
  • Reduced Formula: Ba(AlSi)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm