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Density Functional Theory I - Functionals and Effective Potentials (Paperback, Softcover reprint of the original 1st ed. 1996)

E. J. Baerends; Edited by R.F. Nalewajski; Contributions by K. Burke, E. Ernzerhof, D.J.W. Geldart, …

R2,945 Discovery Miles 29 450

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Theoretical Models of Chemical Bonding - Part 4: Theoretical Treatment of Large Molecules and Their Interactions (Paperback, 1991 ed.)

Zvonimir B. Maksic; Contributions by J. G. Angyan, A. Van Der Avoird, E. J. Baerends, R. Bonaccorsi, …

R1,631 Discovery Miles 16 310

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The state-of-the-art in contemporary theoretical chemistry is presented in this 4-volume set with numerous contributions from the most highly regarded experts in their field. It provides a concise introduction and critical evaluation of theoretical approaches in relation to experimental evidence.