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- W2079711640 abstract "Using a recently commissioned tandem mass spectrometer system, BESTOF, we have carried out systematic investigations (using also deuterated molecules) on the interaction of various molecular cluster ions (including stoichiometric acetone and acetonitrile cluster ions and protonated ethanol cluster ions) with a hydrocarbon-covered stainless steel surface. Besides observing competitive chemical reactions for the stoichiometric cluster ions driven by the energy transfer in the surface collision (intra-cluster reactions versus surface H-atom pick-up reactions), we were able to see clear evidence that unimolecular dissociation kinetics determines the production of the observed decay patterns in collision energy-resolved mass spectra (CERMS). From characteristic shifts in these CERMS we can deduce corresponding binding energies, i.e., {D}((CD3CN)2+ - CD3CN) = 0.66 eV, {D}((C2H5OH)2H+ - C2H5OH) = 0.95 eV, and for the protonated dimer {D}((C2H5OH)H+ - C2H5OH) = 1.6 eV. The first value is in good agreement with values currently calculated using the B3LYP (Becke-Lee-Yang-Parr) density functional and the 6-311G(d, p) basis set, the latter values are in good agreement with values derived earlier from thermochemical data." @default.
- W2079711640 created "2016-06-24" @default.
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- W2079711640 date "2003-01-23" @default.
- W2079711640 modified "2023-09-24" @default.
- W2079711640 title "Surface-induced reactions and dissociations of small acetone, acetonitrile and ethanol cluster ions: competitive chemical reactions, dissociation mechanisms and determination of dissociation energy" @default.
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- W2079711640 doi "https://doi.org/10.1088/1367-2630/5/1/309" @default.
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