1303782
9780792324232
This book offers a unique perspective on the rapidly growing field of numerical grid methods applied to the solution of the Schrödinger equation. Several articles provide comprehensive reviews of the discrete variable and pseudo-spectral operator representation. The applications include sophisticated refinements of the basic approaches with emphasis on successful parallel implementation. The range of problems considered is broad including reactive scattering, photoexcitation processes, mixed quantum--classical methodology, and density functional electronic structure calculations. The book thus serves as a direct introduction to numerical grid methods and as a guide to future research.Cerjan, C. is the author of 'Numerical Grid Methods and Their Application to Schrodinger's Equation' with ISBN 9780792324232 and ISBN 0792324234.
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