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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-10990
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 10
  • Number of elements: 2
  • Element list: ['Ca', 'Hg']
  • Chemical System: Ca-Hg
  • Density: 5.727961787423843
  • Atomic Density: 0.03307793055392469
  • Unit Cell Volume: 302.3163732597383
  • Molar Volume: 18.205917538228444
  • Full Formula: Ca6 Hg4
  • Reduced Formula: Ca3Hg2
  • Formula Anonymous: A2B3
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm