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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91348
  • 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: 2
  • Element list: ['Nb', 'Br']
  • Chemical System: Br-Nb
  • Density: 4.40507071214515
  • Atomic Density: 0.032323153640297295
  • Unit Cell Volume: 1485.0036148749537
  • Molar Volume: 18.63104332892875
  • Full Formula: Nb8 Br40
  • Reduced Formula: NbBr5
  • Formula Anonymous: AB5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm