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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1216096
  • Created at: Sept. 4, 2022, 3:39 p.m.
  • Last updated at: Sept. 4, 2022, 3:39 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 3
  • Number of elements: 1
  • Element list: ['Ti']
  • Chemical System: Ti
  • Density: 4.664964728056452
  • Atomic Density: 0.058689857819582254
  • Unit Cell Volume: 51.11615722808976
  • Molar Volume: 10.260956464594932
  • Full Formula: Ti3
  • Reduced Formula: Ti
  • Formula Anonymous: A
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m