TITLE

Vibrationally and rotationally resolved angular distributions for

AUTHOR(S)
Dharmasena, Gamini; Phillips, Timothy R.
PUB. DATE
June 1997
SOURCE
Journal of Chemical Physics;6/15/1997, Vol. 106 Issue 23, p9950
SOURCE TYPE
Academic Journal
DOC. TYPE
Article
ABSTRACT
Examines the angular distributions for individually resolved states from the reaction between fluorine and hydrogen. Achievement of vibrational and rotational resolution by applying laser and bolometer detection techniques to crossed-beam reactive scattering; Observation of products scattered into the forward hemisphere.
ACCESSION #
4278700

 

Related Articles

  • A coupled cluster study of the classical barrier height of the F+H2→FH+H reaction. Scuseria, Gustavo E. // Journal of Chemical Physics;11/15/1991, Vol. 95 Issue 10, p7426 

    Basis sets as large as F[7s7p5d4f2g]/H[6s5p4d2f] have been used in connection with the coupled cluster method including all single, double, and perturbative triple excitations [CCSD(T)] to predict the classical barrier height of the F+H2→FH+H reaction. Employing transition state...

  • Anhydrous HF in solid-liquid reaction. Yadav, G.D. // Chemical Business;Dec99, Vol. 13 Issue 12, p20 

    Reports that the generation of hydrogen fluoride by chemical reaction of some solids in the presence of an organic phase containing the substrate is proposed as an alternative to other fluorination methods.

  • Two-vector correlations and microscopic branching in chemical dynamics: Alignment and orientation effects for the Mg+HF→MgF+H reaction. Alvariño, José María; Laganà, Antonio // Journal of Chemical Physics;7/15/1991, Vol. 95 Issue 2, p998 

    Correlations between vector parameters characterizing the Mg+HF→MgF+H reaction have been investigated by carrying out extended trajectory calculations. For this study, use has been made not only of the traditional trajectory output, but also of vector distributions and related Legendre...

  • Morphology and defect properties of the Ge–GeO2 interface. Tsetseris, L.; Pantelides, S. T. // Applied Physics Letters;12/28/2009, Vol. 95 Issue 26, p262107 

    Ge-based devices, currently being pursued as replacement of their Si counterparts, typically contain a germanium oxide layer next to the substrate. Here we show using first-principles calculations that, in contrast to Si technology, hydrogenation and fluorination are not effective ways of...

  • Investigation of the F+H2 transition state region via photoelectron spectroscopy of the FH-2 anion. Weaver, A.; Metz, R. B.; Bradforth, S. E.; Neumark, D. M. // Journal of Chemical Physics;10/1/1990, Vol. 93 Issue 7, p5352 

    The photoelectron spectrum of the FH-2 anion is reported. The spectrum provides a probe of the transition state region for the F+H2 reaction. The experimental spectrum is compared to the recent simulation by Zhang and Miller which assumes the T5a potential energy surface for the F+H2 reaction....

  • Dual-level direct dynamics studies on the hydrogen abstraction reactions of fluorine atoms with CFCHX(X=F, Cl). Wang, Li; Zhao, Yuan; Zhang, Jing; Dai, Yanna; Zhang, Jinglai // Theoretical Chemistry Accounts: Theory, Computation, & Modeling;Feb2011, Vol. 128 Issue 2, p183 

    The kinetic properties of the hydrogen abstraction reactions of CFCHF + F → CFCHF + HF (R1) and CFCHCl + F → CFCHCl + HF (R2) have been studied by dual-level direct dynamics method. Optimized geometries and frequencies of all the stationary points and extra points along the...

  • Electrochemical Fluorination of Benzamide and Acetanilide in Anhydrous HF and in Acetonitrile. Shainyan, B. A.; Danilevich, Yu. S.; Grigor'eva, A. A.; Chuvashev, Yu. A. // Russian Journal of Organic Chemistry;Apr2004, Vol. 40 Issue 4, p513 

    Electrochemical fluorination of benzamide in anhydrous hydrogen fluoride does not involve the amide group but occurs exclusively at the aromatic ring, yielding isomeric fluoro- and difluorobenzamides and 3,3,6,6-tetrafluoro-1,4-cyclohexadienecarboxamide. Electrochemical fluorination of benzamide...

  • Assignment of peaks in photodetachment spectra using predicted densities of reactive states: Application to H2F- and D2F-. Kress, J. D.; Hayes, E. F. // Journal of Chemical Physics;10/1/1992, Vol. 97 Issue 7, p4881 

    Accurate cumulative reaction probabilities and densities of reactive states have been obtained for the reactions F+H2→H+HF and F+D2→D+DF using the hyperspherical (APH) coordinate scattering method developed by Pack and Parker. Results for scattering energies ranging from threshold...

  • Accurate three-dimensional quantum scattering calculations for the F+H2 reaction on a new potential energy surface. Kress, Joel D. // Journal of Chemical Physics;3/15/1993, Vol. 98 Issue 6, p5106 

    Accurate 3D quantum reaction probabilities for the F+H2→HF+H reaction are presented for the new 5SEC potential energy surface (PES) of Truhlar and co-workers. This PES was found to be more reactive, on the average, than the closely related 5A PES of Truhlar and co-workers. The resonance...

Share

Read the Article

Courtesy of NEW JERSEY STATE LIBRARY

Sorry, but this item is not currently available from your library.

Try another library?
Sign out of this library

Other Topics