Reaction dynamics of temperature-variable anion water clusters studied with crossed beams and by direct dynamics

Chemical Dynamics Simulations of X– + CH3Y → XCH3 + Y– Gas-Phase SN2 Nucleophilic Substitution Reactions. Nonstatistical Dynamics and Nontraditional Reaction Mechanisms

(2012) Paranjothy Manikandan et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Single solvent molecules can affect the dynamics of substitution reactions

(2012) R. Otto et al.   Nature Chemistry

NWChem: A comprehensive and scalable open-source solution for large scale molecular simulations

(2010) M. Valiev et al.   COMPUTER PHYSICS COMMUNICATIONS

Electronic Structure Theory Study of the F−+ CH3I → FCH3+ I−Potential Energy Surface†

(2010) Jiaxu Zhang et al.   JOURNAL OF PHYSICAL CHEMISTRY A

F− + CH3I → FCH3 + I− Reaction Dynamics. Nontraditional Atomistic Mechanisms and Formation of a Hydrogen-Bonded Complex

(2010) Jiaxu Zhang et al.   Journal of Physical Chemistry Letters

Radiofrequency multipole traps: tools for spectroscopy and dynamics of cold molecular ions

(2009) Roland Wester   JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS

Numerical simulations of kinetic ion temperature in a cryogenic linear multipole trap

(2008) Oskar Asvany et al.   INTERNATIONAL JOURNAL OF MASS SPECTROMETRY

Inverse Temperature Dependent Lifetimes of Transient SN2 Ion-Dipole Complexes

(2008) J. Mikosch et al.   JOURNAL OF PHYSICAL CHEMISTRY A

The Extent of Non-Born-Oppenheimer Coupling in the Reaction of Cl(2P) with para-H2

(2008) X. Wang et al.   SCIENCE

Imaging Nucleophilic Substitution Dynamics

(2008) J. Mikosch et al.   SCIENCE