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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-105345
  • 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: 5
  • Number of elements: 4
  • Element list: ['Y', 'Zn', 'Cu', 'P']
  • Chemical System: Cu-P-Y-Zn
  • Density: 5.180315106391561
  • Atomic Density: 0.05574634224961621
  • Unit Cell Volume: 89.69198333428635
  • Molar Volume: 10.802754973652931
  • Full Formula: Y1 Zn1 Cu1 P2
  • Reduced Formula: YZnCuP2
  • Formula Anonymous: ABCD2
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1