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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-34637
  • 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: 22
  • Number of elements: 4
  • Element list: ['Ba', 'Na', 'Si', 'O']
  • Chemical System: Ba-Na-O-Si
  • Density: 3.5318709035322975
  • Atomic Density: 0.0697412329805842
  • Unit Cell Volume: 315.451836163045
  • Molar Volume: 8.634978910792343
  • Full Formula: Ba2 Na4 Si4 O12
  • Reduced Formula: BaNa2(SiO3)2
  • Formula Anonymous: AB2C2D6
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2