Ergebnisse einschränken

Dokumententyp

Institution

Spezialsammlung

Sprache

Université de Fribourg

Uptake of atmospheric molecules by ice nanoparticles: Pickup cross sections

Lengyel, J. ; Kočišek, J. ; Poterya, V. ; Pysanenko, A. ; Svrčková, P. ; Fárník, M. ; Zaouris, D. K. ; Fedor, Juraj

In: Journal of Chemical Physics, 2012, vol. 137, p. 034304

Uptake of several atmospheric molecules on free ice nanoparticles was investigated. Typical examples were chosen: water, methane, NOx species (NO, NO₂), hydrogen halides (HCl, HBr), and volatile organic compounds (CH₃OH, CH₃CH₂OH). The cross sections for pickup of these molecules on ice nanoparticles (H₂O)N with the mean size of ***Missing image...

Université de Fribourg

On the role of the II(1/2g) state in spontaneous dissociation of krypton and xenon dimer ions

Fedor, Juraj ; Echt, O. ; Głuch, K. ; Matt-Leubner, S. ; Scheier, P. ; Märk, T.D.

In: Chemical Physics Letters, 2007, vol. 437, no. 4-6, p. 183-188

We have measured kinetic-energy-release distributions (KERD) for spontaneous dissociation of electronically excited dimer ions of krypton and xenon, formed by electron impact ionization of neutral precursors. The data cannot be reconciled by decay of the strongly bound II(1/2u) state that successfully explains dissociation of and Ne₂⁺ and Ar₂⁺. Instead, the KERD is dominated by...

Université de Fribourg

Partial cross sections for dissociative electron attachment to tetrahydrofuran reveal a dynamics-driven rich fragmentation pattern

Janečková, Radmila ; May, Olivier ; Milosavljević, A.R. ; Fedor, Juraj

In: International Journal of Mass Spectrometry, 2014, vol. 365–366, p. 163–168

We report partial absolute cross sections for dissociative electron attachment (DEA) to tetrahydrofuran C₄H₈O. The high sensitivity of the present setup, quantitative DEA spectrometer with time-of-flight analyzer, led to identification of a number of previously unreported fragments (CH₂⁻, OH⁻, CHO⁻, C₄H₅O⁻, C₃H₃⁻) thus revealing complex dissociation dynamics of the...

Université de Fribourg

Oxidation of sterols: energetics of C–H and O–H bond cleavage

Lengyel, Jozef ; Rimarčík, Ján ; Vagánek, Adam ; Fedor, Juraj ; Lukeš, Vladimír ; Klein, Erik

In: Food Chemistry, 2012, vol. 133, no. 4, p. 1435–1440

Phytosterols, as components of human diet, received much attention because of their cholesterol-lowering and antioxidant properties. We have theoretically studied sterols oxidation in terms of O–H and C–H bond dissociation enthalpies (BDE). In 17 Δ⁵- and Δ⁷-sterols, BDEs were obtained for reported sites of oxidation attack. Obtained results indicate that Δ⁷-sterols are more...

Université de Fribourg

Low-energy electron attachment to the dichlorodifluoromethane (CCl₂F₂) molecule

Graupner, K. ; Haughey, S. A. ; Field, T. A. ; Mayhew, C. A. ; Hoffmann, T. H. ; May, Olivier ; Fedor, Juraj ; Allan, Michael ; Fabrikant, Ilya I. ; Illenberger, E. ; Braun, M. ; Ruf, M.-W. ; Hotop, Hartmut

In: The Journal of Physical Chemistry A, 2010, vol. 114, no. 3, p. 1474–1484

Results from a joint experimental study of electron attachment to dichlorodifluoromethane (CCl₂F₂) molecules in the gas phase are reported. In a high resolution electron beam experiment involving two versions of the laser photoelectron attachment method, the relative cross section for formation of the dominant anion Cl⁻ was measured over the energy range 0.001−1.8 eV at the gas...

Université de Fribourg

Long-lived transient anion of c-C₄F₈O

Kočišek, J. ; Janečková, Radmila ; Fedor, Juraj

In: The Journal of Chemical Physics, 2018, vol. 148, no. 7, p. 074303

We report partial cross sections for electron attachment to c-C4F8O, a gas with promising technological applications in free-electron-rich environments. The dissociative electron attachment leads to a number of anionic fragments resulting from complex bond-breaking and bond-forming processes. However, the anion with the highest abundance is the non-dissociated (transient) parent anion which...

Université de Fribourg

Isotope effect in dissociative electron attachment to acetylene

May, Olivier ; Fedor, Juraj ; Allan, Michael

In: Physical Review A, 2009, vol. 80, no. 1, p. 012706

Absolute partial cross sections for dissociative electron attachment to H–C≡C–H and D–C≡C–D have been measured using a time-of-flight ion spectrometer combined with a trochoidal electron monochromator. For C₂H₂ the present data are in good agreement with the total cross sections measured previously in our laboratory using the total ion-collection method. The present measurements...

Université de Fribourg

Improved nonlocal resonance model for electron – HCl collisions

Fedor, Juraj ; Kolorenč, P. ; Čižek, M. ; Horáček, J. ; Winstead, C. ; McKoy, V.

In: Journal of Physics: Conference Series, 2009, vol. 194, p. 052036

We present an improved nonlocal resonance model for electron-HCl collisions. The short-range part of the model is based on ab-initio electron scattering eigenphase sums calculated using the Schwinger Multichannel method and the long-range part on the potential curve of the bound HCl⁻ anion. We have calculated cross sections for vibrational excitation and dissociative electron attachment....

Université de Fribourg

Growth of ice nanoparticles via uptake of individual molecules: pickup cross sections

Fedor, Juraj ; Lengyel, Jozef ; Kočišek, J. ; Poterya, V. ; Pysanenko, A. ; Svrčková, P. ; Fárník, M.

In: Journal of Physics: Conference Series, 2014, vol. 488, no. 10, p. 102016

We present cross sections for pickup of several atmospherically relevant molecules on ice nanoparticles with the 0.5-3 nm diameter range. The experimental values are supported by molecular dynamics simulations and analytical calculations based on long-range cluster-molecule potentials. The cross sections are all considerably larger than the geometrical cross section of nanoparticle and vary...

Université de Fribourg

Experimental evidence on the mechanism of dissociative electron attachment to formic acid

Janečková, Radmila ; Kubala, Dušan ; May, Olivier ; Fedor, Juraj ; Allan, Michael

In: Physical Review Letters, 2013, vol. 111, no. 21, p. 213201

Two mechanisms for dissociative electron attachment in HCOOH, the formation of HCOO−+H, were proposed in the literature: (i) via a direct electron attachment into a σ∗ resonance, augmented by dipole binding of the incident electron [G. A. Gallup et al., Phys. Rev. A 79, 042701 (2009)], and (ii) with the 1.8 eV π∗ resonance as a doorway state, linked to the products by...