Theoretical studies of molecular collisions. Final Report
Technical Report
·
OSTI ID:5457942
The following subject areas are covered: (1) total integral reactive cross sections and vibrationally resolved reaction probabilities for F + H{sub 2} = HF + H; (2) a theoretical study of inelastic O + N{sub 2} collisions; (3) body frame close coupling wave packet approach to gas phase atom-rigit rotor inelastic collisions; (4) wave packet study of gas phase atom-rigit motor scattering; (5) the application of optical potentials for reactive scattering; (6) time dependent, three dimensional body frame quantal wave packet treatment of the H + H{sub 2} exchange reaction; (7) a time dependent wave packet approach to atom-diatom reactive collision probabilities; (8) time dependent wave packet for the complete determination of s-matrix elements for reactive molecular collisions in three dimensions; (9) a comparison of three time dependent wave packet methods for calculating electron-atom elastic scattering cross sections; and (10) a numerically exact full wave packet approach to molecule-surface scattering.
- Research Organization:
- Houston Univ., TX (United States)
- OSTI ID:
- 5457942
- Report Number(s):
- N-91-22846; NASA-CR--188190; NAS--1.26:188190; CNN: NAG2-503
- Country of Publication:
- United States
- Language:
- English
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Related Subjects
656003* -- Condensed Matter Physics-- Interactions between Beams & Condensed Matter-- (1987-)
75 CONDENSED MATTER PHYSICS
SUPERCONDUCTIVITY AND SUPERFLUIDITY
BEAMS
CHEMICAL REACTIONS
CROSS SECTIONS
DATA
DOCUMENT TYPES
ELASTIC SCATTERING
ELEMENTS
FLUORINE
HALOGENS
HYDROGEN
INELASTIC SCATTERING
INFORMATION
INTERACTIONS
MOLECULAR BEAMS
NITROGEN
NONMETALS
NUMERICAL DATA
OXYGEN
PROBABILITY
PROGRESS REPORT
SCATTERING
THEORETICAL DATA
75 CONDENSED MATTER PHYSICS
SUPERCONDUCTIVITY AND SUPERFLUIDITY
BEAMS
CHEMICAL REACTIONS
CROSS SECTIONS
DATA
DOCUMENT TYPES
ELASTIC SCATTERING
ELEMENTS
FLUORINE
HALOGENS
HYDROGEN
INELASTIC SCATTERING
INFORMATION
INTERACTIONS
MOLECULAR BEAMS
NITROGEN
NONMETALS
NUMERICAL DATA
OXYGEN
PROBABILITY
PROGRESS REPORT
SCATTERING
THEORETICAL DATA