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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100669
  • 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: 6
  • Number of elements: 2
  • Element list: ['Ca', 'Mg']
  • Chemical System: Ca-Mg
  • Density: 1.7075128867180678
  • Atomic Density: 0.029531259389294618
  • Unit Cell Volume: 203.1745385764029
  • Molar Volume: 20.39242783591914
  • Full Formula: Ca4 Mg2
  • Reduced Formula: Ca2Mg
  • Formula Anonymous: AB2
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm