Understanding Molecular Simulation

Author: Daan Frenkel
Publisher: Academic Press
ISBN: 9780080519982
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Several new examples have been added since the first edition to illustrate recent applications. Questions are included in this new edition. No prior knowledge of computer simulation is assumed.

Industrial Applications Of Molecular Simulations

Author: Marc Meunier
Publisher: CRC Press
ISBN: 1439861021
Size: 72.80 MB
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Theory Simul..9,.2000,.293. . 4..Y..Tamai,.H..Tanaka.and.K..Nakanishi..Molecular.
simulation.of.permeation.of.small. penetrants.through.membranes..
Macromolecules.27,.1994,.4498. . 5.. A.. R.. Leach.. Molecular Modelling,
Principles and Applications.. London:. Pearson. Education.Limited,.1996. . 6.. D..
Frenkel. and. B.. Smit.. Understanding Molecular Simulation. From Algorithms to
Applications..Computational.Science.Series..Vol.1..Second.Edition..London:.
Academic. Press,.2002.

Nano Droplets At Birth

Author: Jan Wedekind
Publisher: Cuvillier Verlag
ISBN: 3867270848
Size: 39.74 MB
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Auflage (Spektrum Akademischer Verlag, Heidelberg, 2003). Ford, I. J. and C. F.
Clement, Journal of Physics a-Mathematical and General 22 (18), 4007(1989).
Frenkel, D. and B. Smit, Computational Science Series, Vol. 1: Understanding
Molecular Simulation, 2nd (Academic Press, San Diego, 2002). Frenkel, D. and B
. Smit, Webpage of the Book "Understanding Molecular Simulation: From
Algorithms to Applications, second edition", http://molsim.chem.uva.nl/
frenkel_smit/index.html, ...

Charge Dynamics In Organic Semiconductors

Author: Pascal Kordt
Publisher: Walter de Gruyter GmbH & Co KG
ISBN: 3110473631
Size: 35.61 MB
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45, 11623–11627, Nov. 1994. D. Frenkel and B. Smit, Understanding molecular
simulation: from algorithms to applications, 2nd ed., ser. Computational science
series. San Diego: Academic Press, 2002, no. 1. M. P. Allen, “Introduction to
Molecular Dynamics Simulation,” in Computational Soft Matter: From Synthetic
Polymers to Proteins,, ser. NIC Series. Jülich: John von Neumann Institute for
Computing, 2004, vol. 23, 1 – 28. T. Bereau and K. Kremer, “Automated
Parametrization of ...

Handbook Of Peridynamic Modeling

Author: Florin Bobaru
Publisher: CRC Press
ISBN: 1315355949
Size: 47.88 MB
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Communications in Mathematical Sciences, 5(4): 851864, 2007. [8] E. Emmrich
and O. Weckner. The peridynamic equation and its spatial discretisation.
Mathematical Modelling and Analysis, 12(1): 1727,2007. [9] D. Frenkel and B.
Smit. Understanding Molecular Simulation: From Algorithms to Applications,
volume 1 of Computational Science Series, 2nd ed. Academic Press, 2002. [10]
G. N. Greaves. Poisson's ratio over two centuries: challenging hypotheses. Notes
and Records of ...

Dynamical Systems Number Theory And Applications

Author: Thomas Hagen
Publisher: World Scientific
ISBN: 981469987X
Size: 44.56 MB
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Daan Frenkel and Berend Smit. Understanding Molecular Simulation, volume 1
of Computational Science Series. Academic Press, Inc., Orlando, FL, USA,
second edition, 2002. David Gilbarg and Neil S. Trudinger. Elliptic partial
differential equations of second order. Classics in Mathematics. Springer-Verlag,
Berlin, 2001. Reprint of the 1998 edition. Richard E. Gillilan and Kent R. Wilson.
Shadowing, rare events, and rubber bands. a variational Verlet algorithm for
molecular dynamics ...

Mathematical Tools For Physicists

Author: Michael Grinfeld
Publisher: John Wiley & Sons
ISBN: 3527684271
Size: 21.56 MB
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Mathematical Tools for Physicists, Second Edition. ... Rebbi, C. (1984), in: K.
Binder Ed. Application of the Monte-Carlo Method in Statistical Physics, Springer,
Berlin, p. ... Understanding Molecular Simulation: From Algorithms to Applications
, San Diego, CA: Academic Press, and by D. P. Landau and K. Binder A Guide to
MonteCarlo Simulations in Statistical Physics, Cambridge: Cambridge University
Press Practical Considerations are emphasized in B. A. Berg (2004) Markov
Chain ...

Bulletin Of The Korean Chemical Society

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Frenkel, D.; Smit, B. Understanding Molecular Simulation: from Algorithms to
Applications. 2nd ... Computer Simulation of Bio- molecular Systems: Theoretical
and Experimental Applications; ESCOM: Leiden, 1989. 11. ... 1998: Vol. 3, pp
1620- 1628. 14. Auffinger, P.; Weshof. E. Molecular Dynamics: Simulation of
Nucleic Acids, ... W. H. Numerical Recipes in FORTRAN: The Art of Scientific
Computing. 2nd ed.: Cambridge University Press: Cambridge, England: New
York, NY, 1 992. 22.

Perfectly Matched Multiscale Simulations

Author: Xiaohu Liu
Publisher:
ISBN:
Size: 37.88 MB
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Computer Methods in Applied Mechanics and Engineering, 193:4837– 4856,
2004. D. Frenkel and B. Smit. Understanding Molecular Simulation: From
Algorithm to Applications. Academic Press, 2nd edition, 2002. ... Composites
Science and Technology, 65:2416–2434, 2005. K. Gottfried. Quantum mechanics
, volume 1.

American Book Publishing Record

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Size: 80.74 MB
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ill.; 26 cm. "Based on a workshop held April 6 to 16th, 1999 at the Isaac Newton
Institute for Mathematical Sciences" — Preface. Includes ... S797 vol. 176, QD461
] 21 2001-049857 ISBN 3-540-4269 M 99.00 1. Intermolecular forces. 2. Infrared
spectroscopy. I. Title. II. Series. ... Series. FRENKEL. Daan. 1948- 539'.6'0113
Understanding molecular simulation: from algorithms to applications / Daan
Frenkel, Berend Smit. 2nd ed. San Diego: Academic Press, c2002..xxii, 638 p.: ill.
; 24 cm.