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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-55389
  • 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: 27
  • Number of elements: 4
  • Element list: ['Ca', 'Al', 'W', 'O']
  • Chemical System: Al-Ca-O-W
  • Density: 3.026866319922145
  • Atomic Density: 0.06458548252440915
  • Unit Cell Volume: 418.0506043257591
  • Molar Volume: 9.32429475575106
  • Full Formula: Ca4 Al6 W1 O16
  • Reduced Formula: Ca4Al6WO16
  • Formula Anonymous: AB4C6D16
  • Spacegroup Number: 217
  • Spacegroup Symbol: I-43m
  • Crystal System: cubic
  • Pointgroup: -43m