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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-30191
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 16
  • Number of elements: 3
  • Element list: ['Mg', 'Cl', 'O']
  • Chemical System: Cl-Mg-O
  • Density: 2.3547195215833083
  • Atomic Density: 0.05100405147070778
  • Unit Cell Volume: 313.7005696339434
  • Molar Volume: 11.807181167673681
  • Full Formula: Mg4 Cl8 O4
  • Reduced Formula: MgCl2O
  • Formula Anonymous: ABC2
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m