3-DIMENSIONAL TIME-DEPENDENT QUANTUM-MECHANICAL STUDY OF THE REACTIONHE-]HEH(+)+H(H(2)+)

Authors
BALAKRISHNAN N SATHYAMURTHY N
Citation
N. Balakrishnan et N. Sathyamurthy, 3-DIMENSIONAL TIME-DEPENDENT QUANTUM-MECHANICAL STUDY OF THE REACTIONHE-]HEH(+)+H(H(2)+), Proceedings of the Indian Academy of Sciences. Chemical sciences, 106(2), 1994, pp. 531-538
Citations number
43
Categorie Soggetti
Chemistry
Journal title
Proceedings of the Indian Academy of Sciences. Chemical sciences → ACNP
ISSN journal
02534134
Volume
106
Issue
2
Year of publication
1994
Pages
531 - 538
Database
ISI
SICI code
0253-4134(1994)106:2<531:3TQSOT>2.0.ZU;2-H
Abstract
We report the results of a three-dimensional time-dependent quantum me chanical study of the reaction He + H-2+ (upsilon = 0, 1) --> HeH+ + H at [E(trans)] = 1.0 eV, which reproduces clearly the vibrational enha ncement for the system. In addition, preliminary results for He + HD(upsilon = 1-3) suggest the preferential formation of HeD+ over HeH+ i n the products.