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Quasiclassical trajectory calculations of vibrational relaxation rates in some atom-diatomic molecule systems

Conference ·
OSTI ID:4108723
Quasiclassical trajectory studies of energy transfer for a number of atom-diatomic molecule systems employing semiempirical (valence-bond) potential- energy surfaces are presented. The systems studied include: I + H$sub 2$, Cl + H$sub 2$, Cl + HCl, H + HCl, F + HF, F + DF, H + HF, D + HF, H + DF, D + DF, I + I$sub 2$, Cl + Cl$sub 2$, H + HBr, and Br + HBr. 10 figures, 16 references. (GHT)
Research Organization:
Los Alamos Scientific Lab., N.Mex. (USA)
DOE Contract Number:
W-7405-ENG-36
NSA Number:
NSA-33-013017
OSTI ID:
4108723
Report Number(s):
LA-UR--75-2227; CONF-751142--1
Country of Publication:
United States
Language:
English

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Related Subjects

*BROMIDES-- ATOM-MOLECULE COLLISIONS
*BROMINE-- ATOM-MOLECULE COLLISIONS
*CHLORIDES-- ATOM-MOLECULE COLLISIONS
*CHLORINE-- ATOM-MOLECULE COLLISIONS
*DEUTERIUM COMPOUNDS-- ATOM-MOLECULE COLLISIONS
*DEUTERIUM-- ATOM- MOLECULE COLLISIONS
*FLUORINE-- ATOM-MOLECULE COLLISIONS
*HYDROBROMIC ACID-- ATOM-MOLECULE COLLISIONS
*HYDROCHLORIC ACID-- ATOM-MOLECULE COLLISIONS
*HYDROFLUORIC ACID-- ATOM-MOLECULE COLLISIONS
*HYDROGEN-- ATOM-MOLECULE COLLISIONS
*IODIDES-- ATOM-MOLECULE COLLISIONS
*IODINE-- ATOM-MOLECULE COLLISIONS
640304* --Physics Research--Atomic
Molecular & Chemical Physics--Collision Phenomena
ENERGY TRANSFER
N60400* --Physics (Atomic & Molecular)--Collision Phenomena
POTENTIAL ENERGY
ROTATIONAL STATES
VIBRATIONAL STATES