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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-31945
  • 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: 34
  • Number of elements: 4
  • Element list: ['H', 'Pd', 'N', 'Cl']
  • Chemical System: Cl-H-N-Pd
  • Density: 2.5115842562145945
  • Atomic Density: 0.07238629975192731
  • Unit Cell Volume: 469.7021413792426
  • Molar Volume: 8.319448266644764
  • Full Formula: H16 Pd2 N4 Cl12
  • Reduced Formula: H8Pd(NCl3)2
  • Formula Anonymous: AB2C6D8
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1