Skip to main content
Open Access Publications from the University of California

Reaction of a charge-separated ONONO2 species with water in the formation of HONO: An MP2 Molecular Dynamics study

  • Author(s): Varner, ME
  • Finlayson-Pitts, BJ
  • Benny Gerber, R
  • et al.

The reaction of (NO+)(NO3-) with water is modelled in ONONO2·(H2O)4 clusters. Molecular Dynamics simulations using second-order Møller-Plesset perturbation (MP2) theory support the feasibility of the reaction of a charge-separated species to produce HONO and nitric acid. © 2014 the Owner Societies.

Many UC-authored scholarly publications are freely available on this site because of the UC Academic Senate's Open Access Policy. Let us know how this access is important for you.

Main Content
Current View