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Theoretical study of the kinetics of the hydrogen abstraction from methanol. 3. Reaction of methanol with hydrogen atom, methyl, and hydroxyl radicals
- J. Jodkowski, M. T. Rayez, J. Rayez, T. Bérces, S. Dóbé
- Chemistry
- 24 April 1999
Ab initio calculations at different levels of theory have been performed for the title H-abstraction reactions. Total energies at stationary points of the potential energy surfaces for the reaction… Expand
Kinetics of the self-reaction and the reaction with OH of the amidogen radical
- Kjell Fagerström, J. Jodkowski, A. Lund, E. Ratajczak
- Chemistry
- 7 April 1995
Abstract The kinetics of the self-reaction and the reaction with OH of the amidogen radical were studied at 298 K by pulse radiolysis combined with UV detection of NH 2 and OH radicals at 597.7 and… Expand
Theoretical study of the kinetics of the hydrogen abstraction from methanol, 1. Reaction of methanol with fluorine atoms
- J. Jodkowski, Marie-Thérèse Rayez, Jean-Claude Rayez, T. Bérces, S. Dóbé
- Chemistry
- 10 October 1998
Ab initio calculations at different levels of theory and using several basis sets were performed for the title two-channel hydrogen-abstraction reaction. Conclusions are drawn from G2 energies. These… Expand
Experimental and theoretical studies of the reaction between CF3 and NO2 at 298 K
- P. Pagsberg, J. Jodkowski, E. Ratajczak, A. Sillesen
- Chemistry
- 3 April 1998
Abstract The title reaction has been studied by pulse radiolysis combined with time-resolved infrared diode laser spectroscopy. The kinetics of CF 3 were analysed taking into account the two… Expand
Kinetics of the gas-phase reaction between ethyl and hydroxyl radicals
- Kjell Fagerström, A. Lund, G. Mahmoud, J. Jodkowski, E. Ratajczak
- Chemistry
- 11 June 1993
The kinetics of the reactions C2H5+OH(+M)→products (+M) (1) were studied at room temperature by pulse radiolysis of C2H6/H2O/SF6 mixtures. The ethyl radical decay was followed by monitoring the UV… Expand
Kinetics of the cross reaction between amidogen and methyl radicals
- J. Jodkowski, E. Ratajczak, +4 authors H. Grotheer
- Chemistry
- 23 June 1995
Abstract For the title reaction, the pressure dependent rate coefficients were studied at 298 K using two complementary experimental techniques. Pulse radiolysis combined with UV absorption was… Expand
Experimental and theoretical studies of gas phase NO3 and OH radical reactions with formaldehyde, acetaldehyde and their isotopomers
- B. D’anna, V. Bakken, J. A. Beukes, C. Nielsen, K. Brudnik, J. Jodkowski
- Chemistry
- 16 April 2003
The vapour phase reactions of formaldehyde, formaldehyde-d2, 13C-formaldehyde, acetaldehyde, acetaldehyde-1-d1, acetaldehyde-2,2,2-d3, and acetaldehyde-d4 with NO3 and OH radicals were studied at 298… Expand
Theoretical Study of the Kinetics of the Hydrogen Abstraction from Methanol. 2. Reaction of Methanol with Chlorine and Bromine Atoms
- J. Jodkowski, M. T. Rayez, J. Rayez, T. Bérces, S. Dóbé
- Chemistry
- 27 October 1998
Ab initio calculations at different levels of theory and using several basis sets have been performed for the title two-channel hydrogen-abstraction reactions CH3OH + Cl and Br. These calculations… Expand
Theoretical study of the kinetics and mechanism of the decomposition of trifluoromethanol, trichloromethanol, and tribromomethanol in the gas phase
- K. Brudnik, D. Wójcik-Pastuszka, J. Jodkowski, J. Leszczynski
- Chemistry, Medicine
- Journal of molecular modeling
- 15 October 2008
Ab initio calculations at the G2 level were used in a theoretical analysis of the kinetics of unimolecular and water-accelerated decomposition of the halogenated alcohols CX3OH (X = F, Cl, and Br)… Expand
Pressure and temperature dependence of the gas-phase reaction between methyl and hydroxyl radicals
- Kjell Fagerström, A. Lund, G. Mahmoud, J. Jodkowski, E. Ratajczak
- Chemistry
- 8 July 1994
Abstract The kinetics of the reaction CH 3 + OH (+M)→CH 3 OH(+M) was studied in the temperature range 283–373 K and in the pressure range 85–1000 mbar SF 6 by pulse radiolysis combined with UV… Expand
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