Titlebook: Chemical Reactions; Basic Theory and Com Antonio Laganà,Gregory A. Parker Textbook 2018 Springer International Publishing AG, part of Sprin

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Business benefits of a PLM system,ng their time evolution. From the analysis of the weakness of the transition state (TS) model approach (that is, phenomenologically valid but useless for predicting), the rate of chemical processes is rationalized in terms of collisions of two structureless bodies using classical mechanics. In this

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Antti Saaksvuori,Anselmi Immonenf treating such collisions using a quantum approach to both bound states and elastic scattering. Some basic interaction models are then considered in order to provide support to some fundamental relationships between the shape of the interaction and the formulation of bound states and scattering qua

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https://doi.org/10.1007/978-3-319-62356-6Theoretical Chemistry and Computational Modelling; European Chemistry Thematic Network Association; Eu

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978-3-319-87299-5Springer International Publishing AG, part of Springer Nature 2018

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Antonio Laganà,Gregory A. ParkerMasters level textbook including basic concepts and examples involved in higher complexity multi-scale simulations.Features simple test cases and problems to facilitate the learning process.Provides a