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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35119
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 28
  • Number of elements: 5
  • Element list: ['Ba', 'Al', 'Si', 'N', 'O']
  • Chemical System: Al-Ba-N-O-Si
  • Density: 3.5396149035353157
  • Atomic Density: 0.07561141584573403
  • Unit Cell Volume: 370.3144516844774
  • Molar Volume: 7.96459197680765
  • Full Formula: Ba2 Al2 Si8 N10 O6
  • Reduced Formula: BaAlSi4N5O3
  • Formula Anonymous: ABC3D4E5
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2