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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-121337
  • 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: 28
  • Number of elements: 4
  • Element list: ['Ba', 'Na', 'P', 'O']
  • Chemical System: Ba-Na-O-P
  • Density: 3.9543921026743116
  • Atomic Density: 0.06529772467664506
  • Unit Cell Volume: 428.8051404341615
  • Molar Volume: 9.222588979664602
  • Full Formula: Ba4 Na4 P4 O16
  • Reduced Formula: BaNaPO4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm