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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-16401
  • 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: 6
  • Number of elements: 2
  • Element list: ['Pa', 'As']
  • Chemical System: As-Pa
  • Density: 9.530924084136133
  • Atomic Density: 0.04520849485409666
  • Unit Cell Volume: 132.71841983158387
  • Molar Volume: 13.320816761176227
  • Full Formula: Pa2 As4
  • Reduced Formula: PaAs2
  • Formula Anonymous: AB2
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm