عنوان

Simulation methods for polymers /

0824702476

9780824702472

b719388

Simulation methods for polymers /

[Book]

edited by Michael Kotelyanskii, Doros N. Theodorou.

New York :

Marcel Dekker,

©2004.

xv, 602 pages :

illustrations ;

24 cm

Includes bibliographical references and index.

1. Background / Michael Kotelyanskii and Doros N. Theodorou -- 2. Rotational Isomeric State (RIS) Calculations, with an Illustrative Application to Head-to-Head, Tail-to-Tail Polypropylene / E. Demet Akten, Wayne L. Mattice and Ulrich W. Suter -- 3. Single Chain in Solution / Reinhard Hentschke -- 4. Polymer Models on the Lattice / K. Binder, J. Baschnagel and M. Muller -- 5. Simulations on the Completely Occupied Lattice / Tadeusz Pakula -- 6. Molecular Dynamics Simulations of Polymers / Vagelis A. Harmandaris and Vlasis G. Mavrantzas -- 7. Configurational Bias Techniques for Simulation of Complex Fluids / T. S. Jain and J. J. de Pablo -- 8. Molecular Simulations of Charged Polymers / Andrey V. Dobrynin -- 9. Gibbs Ensemble and Histogram Reweighting Grand Canonical Monte Carlo Methods / Athanassios Z. Panagiotopoulos -- 10. Gibbs Ensemble Molecular Dynamics / Michael Kotelyanskii and Reinhard Hentschke -- 11. Modeling of Polymer Crystals / Gregory C. Rutledge -- 12. Plastic Deformation of Bisphenol-A-Polycarbonate: Applying an Atomistic-Continuum Model / Jae Shick Yang, Won Ho Jo, Serge Santos and Ulrich W. Suter -- 13. Polymer Melt Dynamics / Wolfgang Paul, Mark D. Ediger, Grant D. Smith and Do Y. Yoon -- 14. Sorption and Diffusion of Small Molecules Using Transition-State Theory / Michael L. Greenfield -- 15. Coarse-Graining Techniques / K. Binder, Wolfgang Paul, Serge Santos and Ulrich W. Suter -- 16. CONNFFESSIT: Simulating Polymer Flow / Manuel Laso and Hans Christian Ottinger -- 17. Simulation of Polymers by Dissipative Particle Dynamics / W. K. den Otter and J. H. R. Clarke -- 18. Dynamic Mean-Field DFT Approach for Morphology Development / A. V. Zvelindovsky, G. J. A. Sevink and J. G. E. M. Fraaije

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Polymers-- Simulation methods.

Polymers.

Polymere

Polymers.

Simulation

Kotelyanskii, Michael.

Theodorou, Doros Nicolas.

20201208112054.0

[Book]

Y