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Experimental study of the reactive processes in the gas phase K+ + i-C3H7Cl collisions: A comparison with Li and Na ions
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10.1063/1.4804188
/content/aip/journal/jcp/138/18/10.1063/1.4804188
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/18/10.1063/1.4804188

Figures

Image of FIG. 1.
FIG. 1.

Reactive cross sections vs. CM energy in K + CHCl collision process for the different reactive channels: (a) excitation function for the ion-molecule adduct formation; (b) excitation function for reactions (3) and (4) ; (c) excitation function for reaction (5) . Inset in (a) shows the log-log dependences for experimental data and those expected from a LGS capture model (see text).

Image of FIG. 2.
FIG. 2.

Schematic energy profile along the reaction evolution in K + -CHCl collisions. Dotted lines show alternative reaction pathways. For clarity, only bond distances (in angstroms) are shown for stationary point structures (see text).

Image of FIG. 3.
FIG. 3.

Geometric structures for reactants and products in the different reaction channels for K + CHCl collision process. For clarity, only bond distances (in angstroms) are shown (see text).

Image of FIG. 4.
FIG. 4.

Schematic energy profile along the reaction evolution in Li + CHCl collision process. Discontinuous lines link the different reaction products observed. For clarity, only bond distances (in angstroms) are shown for stationary point structures (see text).

Image of FIG. 5.
FIG. 5.

Schematic energy profile along the reaction evolution in Na + -CHCl collisions. Discontinuous lines link the different reaction products observed. The alternative reaction pathway is shown as dashed-dotted-dotted line. For clarity, only bond distances (in angstroms) are shown for stationary point structures (see text).

Image of FIG. 6.
FIG. 6.

Reactive cross section vs. CM energy in Na + CHCl collision process for the different reactive channels: (a) excitation function for the ion-molecule adduct formation (dotted-dashed line) and reactions (1) and (2) ; (b) excitation function for reactions (3) and (4) .

Image of FIG. 7.
FIG. 7.

Reactive cross section vs. CM energy in Li + CHCl collision process for the different reactive channels: (a) excitation function for the ion-molecule adduct formation (dotted-dashed line) and reactions (1) and (2) ; (b) excitation function for reactions (3) and (4) .

Tables

Generic image for table
Table I.

Reaction energies (Δ ) and zero Kelvin reaction enthalpies (Δ ) for each calculated reaction at the corresponding theory level (see text). Values are shown in eV.

Generic image for table
Table II.

Electronic energies and ZPEs for reactants, products, and stationary points (see text). Values are given in eV.

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/content/aip/journal/jcp/138/18/10.1063/1.4804188
2013-05-13
2014-04-17
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Experimental study of the reactive processes in the gas phase K+ + i-C3H7Cl collisions: A comparison with Li and Na ions
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/18/10.1063/1.4804188
10.1063/1.4804188
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