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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-24321
  • 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: 14
  • Number of elements: 4
  • Element list: ['Na', 'P', 'Pd', 'S']
  • Chemical System: Na-P-Pd-S
  • Density: 2.9302033978003124
  • Atomic Density: 0.04279419695075354
  • Unit Cell Volume: 327.14716007197984
  • Molar Volume: 14.072330337055101
  • Full Formula: Na2 P2 Pd2 S8
  • Reduced Formula: NaPPdS4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 140
  • Spacegroup Symbol: I4/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm