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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23376
  • 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: 12
  • Number of elements: 3
  • Element list: ['Nb', 'Cr', 'P']
  • Chemical System: Cr-Nb-P
  • Density: 7.107854010586854
  • Atomic Density: 0.07301355239568438
  • Unit Cell Volume: 164.35304962246002
  • Molar Volume: 8.247976659680992
  • Full Formula: Nb4 Cr4 P4
  • Reduced Formula: NbCrP
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm