Laser-collision induced chemical reactions: A comparison of quantum mechanical and classical model results
Creators
- 1. Theoretical Atomic and Molecular Physics Group, Lawrence Livermore National Laboratory, University of California, Livermore, California 94550
Description
We compare the results of a classical model for the laser enhancement of the H+LiF→Li+HF reaction to accurate quantum mechanical results. Structure in the reaction probability as a function of collision energy below the fieldfree threshold predicted classically by Orel and Miller is found to be less pronounced in the quantum results. A much better understanding of the various causes of the observed maxima and also of the reliability of this classical model are obtained as a result of these calculations. A fundamental inconsistency in the classical model introduced when the Langer modification is made which can lead to unphysical results is discussed and a procedure for correcting this inconsistency is presented. Improved results are obtained
Additional details
Publishing Information
- Journal Title
- J. Chem. Phys.
- Journal Volume
- 75
- Journal Issue
- 2
- Series
- J. Chem. Phys.
- Journal Page Range
- 675-680
- ISSN
- 0021-9606
INIS
- Country of Publication
- United States
- Country of Input or Organization
- United States
- INIS RN
- 12631853
- Subject category
- S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
- Descriptors DEI
- ATOM-MOLECULE COLLISIONS; CHEMICAL REACTIONS; CLASSICAL MECHANICS; HYDROGEN; LASER RADIATION; LITHIUM FLUORIDES; PHOTOCHEMISTRY; PROBABILITY; QUANTUM MECHANICS
- Descriptors DEC
- ALKALI METAL COMPOUNDS; ATOM COLLISIONS; CHEMISTRY; COLLISIONS; ELECTROMAGNETIC RADIATION; ELEMENTS; FLUORIDES; FLUORINE COMPOUNDS; HALIDES; HALOGEN COMPOUNDS; LITHIUM COMPOUNDS; LITHIUM HALIDES; MECHANICS; MOLECULE COLLISIONS; NONMETALS; RADIATIONS