Journal
FARADAY DISCUSSIONS
Volume 157, Issue -, Pages 41-57Publisher
ROYAL SOC CHEMISTRY
DOI: 10.1039/c2fd20013a
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Funding
- Deutsche Forschungsgemeinschaft [WE 2592/3-2]
- Landesgraduiertenforderung Baden-Wurttemberg
- Marie Curie Initial Training Network ICONIC
- National Science Foundation [CHE-0957416]
- Robert A. Welch Foundation [D-0005]
- High Performance Computing Center (HPCC) at Texas Tech University (TTU) under direction of Philip W. Smith
- Texas Advanced Computing Center (TACC) of the University of Texas at Austin
- TTU Department of Chemistry & Biochemistry cluster Robinson
- National Science Foundation under CRIF-MU Grant [CHE-0840493]
- Direct For Mathematical & Physical Scien
- Division Of Chemistry [0957521] Funding Source: National Science Foundation
- Direct For Mathematical & Physical Scien
- Division Of Chemistry [0840493] Funding Source: National Science Foundation
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We present a study of the different product channels in the reactions of OH- and OH- (H2O) with methyl iodide over a range of collision energies. Direct dynamics classical trajectory simulations are employed to obtain an atomistic comparison with the experimental results. For the experiments we have combined a crossed beam ion imaging setup with a multipole rf ion trap. The trap allows us to prepare the molecular and cluster ions with a controlled internal temperature and thus provides well-defined initial conditions for reaction experiments at low collision energy. Changing the internal temperature of the cluster ions was found to have a profound effect on their reactivity.
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