Dipl.-Phys. Carsten Hennig

Publications

2004

1.  State-selected dynamics of the complex-forming bimolecular reaction
      
Cl- + CH3Cl'  ->  ClCH3+Cl'- : A four-dimensional quantum scattering study
     C. Hennig and S. Schmatz J. Chem. Phys. 121, 220 (2004).

2.  Quantum dynamics of the complex-forming SN2 reaction Cl- + CD3Cl'  ->  ClCD3+Cl'-
      on a four-dimensional coupled cluster potential surface
     P. Botschwina, C. Hennig and S. Schmatz,   Phys. Chem. Chem. Phys. 6, 4630 (2004).


2005

3.  Reduced-dimensionality calculation of reaction cross sections and rate constant for the
     complex-forming gas-phase SN2 reaction Cl- + CH3Cl'  ->  ClCH3+Cl'-
     C. Hennig and S. SchmatzPhys. Chem. Chem. Phys. 7, 1552 (2005).

4.  Four dimensional quantum study on exothermic complex-forming reactions:
     Cl- + CH3Br  ->  ClCH3+Br-
     C. Hennig and S. Schmatz J. Chem. Phys. 122, 234307 (2005).


2006


5.  Rotating top approximation in reduced-dimensionality quantum calculations of rate
     constants: Application to complex-forming nucleophilic substitution
     C. Hennig and S. Schmatz J. Phys. Chem. A 110, 1524 (2006).

6.  Secondary Kinetic Isotope Effect in Nucleophilic Substitution:
     A Quantum-Mechanical Approach

     C. Hennig, Rainer B. Oswald and S. SchmatzJ. Phys. Chem. A 110, 3071 (2006).