Published February 15, 1977
| Version v1
Journal article
Quantal transition probabilities from classical trajectories: application to the collinear reactive H+Cl2 system
Creators
- 1. Israel Atomic Energy Commission, Yavne. Soreq Nuclear Research Center
- 2. Hebrew Univ., Jerusalem (Israel). Dept. of Physical Chemistry
Description
Moments of the classically computed distribution of products vibrational energy are employed to generate a discrete vibrational state distribution. The built-in convergence criterion of the method is discussed and demonstrated. Comparison is made with the quantal results for the collinear H + Cl2 reaction and with the experimental results for the H + F2 reaction. (Auth.)
Additional details
Identifiers
Publishing Information
- Journal Title
- Chemical Physics Letters
- Journal Volume
- 46
- Journal Issue
- 1
- Series
- Chem. Phys. Lett.
- Journal Page Range
- 35-41
- ISSN
- 0009-2614
INIS
- Country of Publication
- Netherlands
- Country of Input or Organization
- Netherlands
- INIS RN
- 8316370
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS;
- Descriptors DEI
- ATOM-MOLECULE COLLISIONS; CHLORINE; DISTRIBUTION; ENERGY SPECTRA; ENTROPY; HYDROGEN; MOLECULES; POTENTIAL ENERGY; PROBABILITY; SCHROEDINGER EQUATION; TRAJECTORIES; VIBRATIONAL STATES
- Descriptors DEC
- ATOM COLLISIONS; COLLISIONS; DIFFERENTIAL EQUATIONS; ELEMENTS; ENERGY; ENERGY LEVELS; EQUATIONS; EXCITED STATES; HALOGENS; MOLECULE COLLISIONS; NONMETALS; PHYSICAL PROPERTIES; SPECTRA; THERMODYNAMIC PROPERTIES
Optional Information
- Notes
- Updated automatically by Metadata and Full-Text Enrichment Agent