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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91330
  • 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: 48
  • Number of elements: 4
  • Element list: ['Cr', 'B', 'Br', 'O']
  • Chemical System: B-Br-Cr-O
  • Density: 3.8209727634847814
  • Atomic Density: 0.10629164399494628
  • Unit Cell Volume: 451.58770902331884
  • Molar Volume: 5.665676560884059
  • Full Formula: Cr6 B14 Br2 O26
  • Reduced Formula: Cr3B7BrO13
  • Formula Anonymous: AB3C7D13
  • Spacegroup Number: 219
  • Spacegroup Symbol: F-43c
  • Crystal System: cubic
  • Pointgroup: -43m