Final state and velocity distribution of the reaction D+H/sub 2/. -->. HD+H as a function of scattering angle
Journal Article
·
· J. Chem. Phys.; (United States)
OSTI ID:5277765
We present quasiclassical trajectory calculations of velocity-angle contour maps and state distributions as a function of scattering angle for the reaction D+H/sub 2/..-->..HD+H. These are calculated using the Liu--Siegbahn--Truhlar--Horowitz potential energy surface. The results show higher vibrational excitation and lower rotational excitation of the backscattered products as compared to the total product distribution. In addition to their fundamental interest, these calculations should be useful in interpreting experiments in which state-to-state differential cross sections are measured.
- Research Organization:
- Chemistry Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545
- OSTI ID:
- 5277765
- Journal Information:
- J. Chem. Phys.; (United States), Journal Name: J. Chem. Phys.; (United States) Vol. 88:9; ISSN JCPSA
- Country of Publication:
- United States
- Language:
- English
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· J. Chem. Phys.; (United States)
·
OSTI ID:5720957
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Journal Article
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· J. Phys. Chem.; (United States)
·
OSTI ID:6685355
Related Subjects
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
400201* -- Chemical & Physicochemical Properties
ATOM COLLISIONS
ATOM-MOLECULE COLLISIONS
CHEMICAL REACTION KINETICS
COLLISIONS
CROSS SECTIONS
DEUTERIUM
DIFFERENTIAL CROSS SECTIONS
ELEMENTS
ENERGY LEVELS
ENERGY-LEVEL TRANSITIONS
EXCITATION
EXCITED STATES
HYDROGEN
HYDROGEN ISOTOPES
ISOTOPES
KINETICS
LIGHT NUCLEI
MOLECULE COLLISIONS
NONMETALS
NUCLEI
ODD-ODD NUCLEI
REACTION KINETICS
ROTATIONAL STATES
STABLE ISOTOPES
VIBRATIONAL STATES
400201* -- Chemical & Physicochemical Properties
ATOM COLLISIONS
ATOM-MOLECULE COLLISIONS
CHEMICAL REACTION KINETICS
COLLISIONS
CROSS SECTIONS
DEUTERIUM
DIFFERENTIAL CROSS SECTIONS
ELEMENTS
ENERGY LEVELS
ENERGY-LEVEL TRANSITIONS
EXCITATION
EXCITED STATES
HYDROGEN
HYDROGEN ISOTOPES
ISOTOPES
KINETICS
LIGHT NUCLEI
MOLECULE COLLISIONS
NONMETALS
NUCLEI
ODD-ODD NUCLEI
REACTION KINETICS
ROTATIONAL STATES
STABLE ISOTOPES
VIBRATIONAL STATES