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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-68892
  • 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: 4
  • Number of elements: 3
  • Element list: ['Be', 'Nb', 'P']
  • Chemical System: Be-Nb-P
  • Density: 4.853539298701944
  • Atomic Density: 0.08238976386296176
  • Unit Cell Volume: 48.549720407660935
  • Molar Volume: 7.309331253839468
  • Full Formula: Be2 Nb1 P1
  • Reduced Formula: Be2NbP
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm