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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-70626
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Be', 'Zn', 'P']
  • Chemical System: Be-P-Zn
  • Density: 3.9405132881256764
  • Atomic Density: 0.08296799867499145
  • Unit Cell Volume: 48.211359366026215
  • Molar Volume: 7.258389808328856
  • Full Formula: Be2 Zn1 P1
  • Reduced Formula: Be2ZnP
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm