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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117225
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 24
  • Number of elements: 3
  • Element list: ['Ba', 'Sr', 'Si']
  • Chemical System: Ba-Si-Sr
  • Density: 3.3543342377777927
  • Atomic Density: 0.03593406178612281
  • Unit Cell Volume: 667.8899853527952
  • Molar Volume: 16.758864599953625
  • Full Formula: Ba4 Sr4 Si16
  • Reduced Formula: BaSrSi4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm