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1.
J Phys Chem A ; 118(31): 6034-49, 2014 Aug 07.
Artículo en Inglés | MEDLINE | ID: mdl-24945616

RESUMEN

An investigation into the dissociative recombination process for H(13)CO(+) using merged ion-electron beam methods has been performed at the heavy ion storage ring CRYRING, Stockholm, Sweden. We have measured the branching fractions of the different product channels at ∼ 0 eV collision energy to be the following: CO + H 87 ± 2%, OH + C 9 ± 2%, and O + CH 4 ± 2%. The formation of electronically excited CO in the dominant reaction channel has also been studied, and we report the following tentative branching fractions for the different CO product electronic states: CO(X (1)Σ(+)) + H, 54 ± 10%; CO(a (3)Π) + H, 23 ± 4%; and CO(a' (3)Σ(+)) + H, 23 ± 4%. The absolute cross section between ∼ 2-50 000 meV was measured and showed resonance structures between 3 and 15 eV. The cross section was fitted in the energy range relevant to astrophysics, i.e., between 1 and 300 meV, and was found to follow the expression σ = 1.3 ± 0.3 × 10(-16) E(-1.29 ± 0.05) cm(2) and the corresponding thermal rate constant was determined to be k(T) = 2.0 ± 0.4 × 10(-7)(T/300)(-0.79 ± 0.05) cm(3) s(-1). Radioastronomical observations with the IRAM 30 m telescope of HCO(+) toward the Red Rectangle yielded an upper column density limit of 4 × 10(11) cm(-2) of HCO(+) at the 1σ level in that object, indicating that previous claims that the dissociative recombination of HCO(+) plays an important role in the production of excited CO molecules emitting the observed Cameron bands in that object are not supported.

2.
Phys Chem Chem Phys ; 10(27): 4014-9, 2008 Jul 21.
Artículo en Inglés | MEDLINE | ID: mdl-18597015

RESUMEN

The dissociative recombination of fully deuterated protonated acetonitrile, CD(3)CND(+), has been investigated at the CRYRING heavy ion storage ring, located at the Manne Siegbahn Laboratory, Stockholm, Sweden. Branching fractions were measured at approximately 0 eV relative collision energy between the ions and the electrons and in 65% of the DR events there was no rupture of bonds between heavy atoms. In the remaining 35%, one of the bonds between the heavy atoms was broken. The DR cross-section was measured between approximately 0 eV and 1 eV relative collision energy. In the energy region between 1 meV and 0.1 eV the cross section data were best fitted by the expression sigma = 7.37 x 10(-16) (E/eV)(-1.23) cm(2), whereas sigma = 4.12 x 10(-16) (E/eV)(-1.46) cm(2) was the best fit for the energy region between 0.1 and 1.0 eV. From the cross section a thermal rate coefficient of alpha(T) = 8.13 x 10(-7) (T/300)(-0.69) cm(3) s(-1) was deduced.


Asunto(s)
Acetonitrilos/química , Deuterio/química , Modelos Químicos , Modelos Moleculares , Protones , Temperatura
3.
Phys Chem Chem Phys ; 9(22): 2856-61, 2007 Jun 14.
Artículo en Inglés | MEDLINE | ID: mdl-17538730

RESUMEN

Dissociative recombination of the deuterated acetaldehyde ion CD3CDO(+) has been studied at the heavy-ion storage ring CRYRING, located at the Manne Siegbahn Laboratory, Stockholm, Sweden. Product branching fractions together with absolute DR cross-sections were measured. The branching fractions were determined at a relative collision energy between the ions and the electrons of approximately 0 eV. With a probability of 34% the DR events resulted in no ruptures of bonds between heavy atoms (i.e. no breakage of the C-C bond or the C[double bond, length as m-dash]O bond). In the remaining 66% of the events one of the bonds between the heavy atoms was broken. The energy-dependent cross-section for the DR reaction was measured between approximately 0 and 1 eV relative kinetic energy. In the energy region between 1 meV and 0.2 eV the absolute cross section could be fitted by the expression sigma(E) = 6.8 x 10(-16)E(-1.28) cm(2), whereas in the energy interval between 0.2 and 1 eV the data were best fitted by sigma(E) = 4.1 x 10(-16)E(-1.60) cm(2). From these cross section data the thermal rate coefficient (as a function of the electron temperature), alpha(T) = 9.2 x 10(-7) (T/300)(-0.72) cm(3) s(-1) was obtained.


Asunto(s)
Acetaldehído/química , Deuterio/química , Modelos Químicos , Modelos Moleculares , Simulación por Computador , Electrones , Iones , Temperatura
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