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Time-dependent wavepacket study of the collinear reaction He + H2+ → HeH+ + H

✍ Scribed by N. Balakrishnan; N. Sathyamurthy

Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
428 KB
Volume
240
Category
Article
ISSN
0009-2614

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✦ Synopsis

State-selected reaction probabilities for the collinear reaction He+H~-(v)~HeH++H have been computed for v = 0-4 over a wide range of energies (to the dissociation limit), using the time-dependent wavepacket approach via time-energy mapping of the reactive flux. The results reproduce quantitatively the narrow reactive scattering resonances observed in earlier time-independent quantum mechanical results of Sakimoto and Onda [Chem. Phys. Letters 226 (1994) 227] thus demonstrating the viability and reliability of the method for such systems.

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