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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-13817
  • 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: 10
  • Number of elements: 2
  • Element list: ['Nb', 'Cl']
  • Chemical System: Cl-Nb
  • Density: 3.1585824496715285
  • Atomic Density: 0.0405196817576897
  • Unit Cell Volume: 246.79364610513585
  • Molar Volume: 14.862260755187538
  • Full Formula: Nb2 Cl8
  • Reduced Formula: NbCl4
  • Formula Anonymous: AB4
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m