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Oxygen interactions with silica surfaces: Coupled cluster and density functional investigation and the development of a new ReaxFF potential

  • Anant D. Kulkarni
  • , Donald G. Truhlar
  • , Sriram Goverapet Srinivasan
  • , Adri C.T. Van Duin
  • , Paul Norman
  • , Thomas E. Schwartzentruber

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