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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-11753
  • 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: 12
  • Number of elements: 3
  • Element list: ['Ba', 'W', 'O']
  • Chemical System: Ba-O-W
  • Density: 6.213335572694116
  • Atomic Density: 0.058288193807234455
  • Unit Cell Volume: 205.87359491160998
  • Molar Volume: 10.331664727707793
  • Full Formula: Ba2 W2 O8
  • Reduced Formula: BaWO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 88
  • Spacegroup Symbol: I4_1/a
  • Crystal System: tetragonal
  • Pointgroup: 4/m