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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-71352
  • 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: ['Na', 'Ca', 'Be']
  • Chemical System: Be-Ca-Na
  • Density: 1.3808208796282837
  • Atomic Density: 0.03498694497200781
  • Unit Cell Volume: 114.32835885500438
  • Molar Volume: 17.21253674711572
  • Full Formula: Na2 Ca1 Be1
  • Reduced Formula: Na2CaBe
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm