Chemical Reaction Dynamics: Gas Phase and Interfaces

Recent Papers in these Areas:

A. M. Zolot, B. G. Perkins, W. W. Harper, P. J. Dagdigian and D. J. Nesbitt, “Quantum-state resolved reaction dynamics at the gas-liquid interface: Direct absorption detection of HF(v,J) product from F(2P) + Squalane,” J. Chem. Phys. 125, 021101 (2006).

B. G. Perkins and D. J. Nesbitt, “Quantum state-resolved CO2 scattering dynamics at the gas-liquid interface: Dependence on incident angle,” J. Phys. Chem. A111, 7420 (2007).

F. Lique, M. H. Alexander, G. Li, H-J. Werner, S. A. Nizkorodov, W. W. Harper and D. J. Nesbitt, ”Evidence of the reactivity of the spin orbit state in the reaction of F with H2,” J. Chem. Phys. 128, 084313 (2008).

B. G. Perkins, Jr. and D. J. Nesbitt, “Quantum state-resolved CO2 collisions at the gas-liquid interface: Surface temperature-dependent scattering dynamics,” J. Phys. Chem. B 112, 507 (2008).

B. G. Perkins, Jr. and D. J. Nesbitt, “Stereodynamics in state-resolved scattering at the gas–liquid interface,” Proc. Nat. Acad. Sciences 105, 12684-12689 (2008).

B. G. Perkins, Jr. and D. J. Nesbitt, “Correlated angular and quantum state resolved CO2 scattering dynamics at the gas-liquid interface,” J. Phys. Chem. A 112, 9324-9335 (2008).

A. M. Zolot, P. J. Dagdigian, and D. J. Nesbitt, “Quantum-state resolved reactive scattering at the gas–liquid interface: F + squalane (C30H62) dynamics via high-resolution infrared absorption of nascent HF(v,J),” J. Chem. Phys. 129, 194705 (2008).

J. J. Nogueira, S. A. Vázquez, O. Mazyar, W. L. Hase, B. G. Perkins, Jr., D. J. Nesbitt, and E. Martínez-Núñez, “Dynamics of CO2 scattering off a perfluorinated self-assembled monolayer: Influence of the incident collision energy, mass effects, and use of different surface models,”  J. Phys. Chem. A, 113, 3850-3865 (2009).

A. M. Zolot and D. J. Nesbitt, “Crossed jet reactive scattering dynamics of F + H2O ® HF(v,J) + OH: HF(v,J) product quantum state distributions under single collision conditions,” J. Chem. Phys. 129, 184305 (2008).  

B. G. Perkins, Jr. and D. J. Nesbitt, “Toward 3D quantum state resolved collision dynamics at the gas-liquid interface: Experiment and theory,” J. Phys. Chem. A 113, 4613-4625 (2009).

M. P. Ziemkiewicz and D. J. Nesbitt, “Non-adiabatic reactive scattering in atom + triatom systems: Nascent rovibronic distributions in F + H2O ® HF + OH,” J. Chem. Phys. 131, 054309 (2009).

B. G. Perkins, Jr. and D. J. Nesbitt, “Stereodynamics at the gas-liquid Interface:  Orientation and alignment of CO2 scattered from perfluorinated liquid surfaces,” J. Phys. Chem. A. 114, 1398-1410 (2010).

J. R. Roscioli and D. J. Nesbitt, “State-resolved scattering at room temperature ionic liquid-vacuum interfaces: Anion dependence and the role of dynamic vs. equilibrium effects,” J. Phys. Chem. Lett. 1, 674 -678 (2010).

B. G. Perkins, Jr. and D. J. Nesbitt, “High resolution Dopplerimetry of correlated angular and quantum state-resolved CO2 scattering dynamics at the gas–liquid interface,” Phys. Chem. Chem. Phys. 12, 14294-14308 (2010).

J. R. Roscioli, D. Bell, and D. J. Nesbitt, “State-resolved velocity map imaging of surface–scattered molecular flux,” Phys. Chem. Chem. Phys. 14, 4013-4304 (2012).

J. R. Roscioli and D. J. Nesbitt, “Quantum state resolved scattering from room temperature ionic liquids: The role of cation vs. anion structure at the interface,” J. Phys. Chem. C. 115, 9764-9773 (2011).

J. R. Roscioli and D. J. Nesbitt, “Quantum state resolved velocity-map imaging spectroscopy: A new tool for collision dynamics at gas/self-assembled monolayer interfaces,” Frontiers in Spectroscopy, Faraday Disc. 150/22, 1-9 (2011).

M. P. Ziemkiewicz, J. R. Roscioli, and D. J. Nesbitt, “State-to-state dynamics at the gas-liquid metal interface:  Rotationally and electronically inelastic scattering of NO[2P1/2(0.5)] from molten gallium,” J. Chem. Phys. 134, 234703 (2011).

P. Casavecchia M. Brouard, M. Costes, D. J. Nesbitt, E. Bieske and S. Kable, “Molecular collision dynamics,” Phys. Chem. Chem. Phys. 13, 8073-8074  (2011).

L. F. Phillips and D. J. Nesbitt, “On the solid surface of liquid gallium,” Chem. Phys. Lett. 536, 61-64 (2012).

M. P. Ziemkiewicz, A. Zutz, and D. J. Nesbitt, “Inelastic scattering of radicals at the gas-ionic liquid interface:  Probing surface dynamics of [bmim][Cl], [bmim][BF4], and [bmim][Tf2N] by rovibronic scattering of NO [2P1/2(0.5)],” J. Phys. Chem. C. http://dx.doi.org/10.1021/jp212336a (2012)

X. Li, G. C. Schatz, and D. J. Nesbitt, “Anion Effects in the Scattering of CO2 from Room Temperature Ionic Liquids [bmim][BF4] and [bmim][Tf2N]: Insights from Quantum Mechanics/Molecular Mechanics Trajectories,” J. Phys. Chem. B 116, 3587-3602 (2012).

A. W. Gisler and D. J. Nesbitt, “On Probing Ions at the Gas-Liquid Interface by Quantum State-Resolved Molecular Beam Scattering: The Curious Incident of the Cation in the Night Time,” Faraday Disc. 157 (in press).