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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-24552
  • 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: 10
  • Number of elements: 3
  • Element list: ['Ba', 'Si', 'Ni']
  • Chemical System: Ba-Ni-Si
  • Density: 5.144091165157234
  • Atomic Density: 0.04982302301295329
  • Unit Cell Volume: 200.71042251691833
  • Molar Volume: 12.087064163959555
  • Full Formula: Ba2 Si4 Ni4
  • Reduced Formula: Ba(SiNi)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm