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Browsing Science (Faculty of) by Subject "ab initio calculations"
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Mass-Selected Infrared Multiple-Photon Dissociation as a Structural Probe of Gaseous Ion-Molecule Complexes (University of Waterloo, 2009-08-31)Mass-selected infrared multiple photon spectroscopy (IRMPD), Fourier transform ion cyclotron resonance (FT-ICR) kinetic experiments, RRKM and electronic structure calculations have been performed in order to propose a ...