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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-56951
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 16
  • Number of elements: 2
  • Element list: ['B', 'Cl']
  • Chemical System: B-Cl
  • Density: 1.8219836035251415
  • Atomic Density: 0.047433173640983074
  • Unit Cell Volume: 337.3166662029067
  • Molar Volume: 12.696052778548992
  • Full Formula: B8 Cl8
  • Reduced Formula: BCl
  • Formula Anonymous: AB
  • Spacegroup Number: 137
  • Spacegroup Symbol: P4_2/nmc
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm