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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-90156
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Pd', 'N', 'Cl']
  • Chemical System: Cl-N-Pd
  • Density: 2.8788781145777977
  • Atomic Density: 0.04494669564511618
  • Unit Cell Volume: 200.23718920431747
  • Molar Volume: 13.398405986390582
  • Full Formula: Pd1 N2 Cl6
  • Reduced Formula: Pd(NCl3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m