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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-114771
  • 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: 4
  • Number of elements: 2
  • Element list: ['N', 'Cl']
  • Chemical System: Cl-N
  • Density: 2.0563436073069883
  • Atomic Density: 0.04115322108676592
  • Unit Cell Volume: 97.19773797454515
  • Molar Volume: 14.633461490907706
  • Full Formula: N1 Cl3
  • Reduced Formula: NCl3
  • Formula Anonymous: AB3
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1