TRANSLATIONAL BASIS SET CONTRACTION IN VARIATIONAL REACTIVE SCATTERING

TRANSLATIONAL BASIS SET CONTRACTION IN VARIATIONAL REACTIVE SCATTERING

A new translational basis set is introduced for quantum reactive scattering calculations that use the log derivative version of the Kohn variational principle. This basis set, which is similar in many respects to that used in electron-atom scattering calculations by Burke and Robb, is obtained by co...

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Bibliografiske detaljer
Main Authors:	Manolopoulos, D, Dmello, M, Wyatt, R
Format:	Journal article
Sprog:	English
Udgivet:	1990

Lignende værker

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Theory, experiment, and the h + d2 reaction.
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Aspects of Legal Translation in Contracts of Carriage
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Cerebrovascular Resistance: The Basis of Cerebrovascular Reactivity
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Inelastic neutron scattering from liquid para-hydrogen by ring polymer molecular dynamics
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H+H2(0,0)-]H2(V',J')+H INTEGRAL CROSS-SECTIONS ON THE DOUBLE MANY-BODY EXPANSION POTENTIAL-ENERGY SURFACE
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CALCULATIONS RELATING TO THE EXPERIMENTAL-OBSERVATION OF RESONANCES IN THE H+H2 REACTION
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Electric field dissociation of H-2(+): close-coupled scattering calculations
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