Understanding Molecular Simulation

Author: Daan Frenkel
Publisher: Academic Press
ISBN: 9780080519982
Size: 18.58 MB
Format: PDF, Mobi
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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: 62.17 MB
Format: PDF, ePub
View: 469
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Marc Meunier. free.volume.distribution.and.size.in.molecular.models.made.of.
many.short.chains. ... Understanding Molecular Simulation. From Algorithms to
Applications..Computational.Science.Series..Vol.1..Second.Edition..London:.

Nano Droplets At Birth

Author: Jan Wedekind
Publisher: Cuvillier Verlag
ISBN: 3867270848
Size: 58.72 MB
Format: PDF, Mobi
View: 5313
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Computer Experiments on Gas Phase Nucleation Jan Wedekind. Bösiger, J. and
... Phys. Lab. Univ. Leiden 118a, 1 (1911). ... Frenkel, D. and B. Smit,
Computational Science Series, Vol. ... Frenkel, D. and B. Smit, Webpage of the
Book "Understanding Molecular Simulation: From Algorithms to Applications,
second edition", ...

Charge Dynamics In Organic Semiconductors

Author: Pascal Kordt
Publisher: Walter de Gruyter GmbH & Co KG
ISBN: 3110473631
Size: 60.90 MB
Format: PDF, ePub
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P. A. M. Dirac, “The Quantum Theory of the Electron,” Proceedings of the Royal
Society of London. Series A, vol. 117, no. 778, 610–624, 1928. P. Kordt, Single-
Site Green ... 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 ...

Handbook Of Peridynamic Modeling

Author: Florin Bobaru
Publisher: CRC Press
ISBN: 1315355949
Size: 60.96 MB
Format: PDF, Docs
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Coarsegraining parametrization and multiscale simulation of hierarchical
systems. Part I: theory and ... Understanding Molecular Simulation: From
Algorithms to Applications, volume 1 of Computational Science Series, 2nd ed.
Academic Press ...

Dynamical Systems Number Theory And Applications

Author: Thomas Hagen
Publisher: World Scientific
ISBN: 9814699888
Size: 61.93 MB
Format: PDF, ePub, Mobi
View: 4424
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The mathematical theory of finite element methods, volume 15 of Texts in Applied
Mathematics. Springer, New York, third edition, 2008. Maria Cameron ...
Understanding Molecular Simulation, volume 1 of Computational Science Series.
Academic Press, Inc., Orlando, FL, USA, second edition, 2002. ... Shadowing,
rare events, and rubber bands. a variational Verlet algorithm for molecular
dynamics.

Molecular Modelling For Beginners

Author: Alan Hinchliffe
Publisher: John Wiley & Sons
ISBN: 1119964814
Size: 78.45 MB
Format: PDF, Mobi
View: 5428
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The text ends with a discussion of transition states and hybrid models. This text will appeal to student taking undergraduate courses in chemistry, pharmacy, biochemistry, chemical engineering and materials science.

Molecular Dynamics Simulation

Author: J. M. Haile
Publisher: University of Texas Press
ISBN: 9780471184393
Size: 44.88 MB
Format: PDF
View: 936
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"Provides a lot of reading pleasure and many new insights." -Journal of Molecular Structure "This is the most entertaining, stimulating and useful book which can be thoroughly recommended to anyone with an interest in computer simulation.

Mathematical Tools For Physicists

Author: Michael Grinfeld
Publisher: John Wiley & Sons
ISBN: 3527684271
Size: 49.68 MB
Format: PDF, ePub, Docs
View: 1559
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Mathematical Tools for Physicists, Second Edition. ... (2008) Science 322, 1224–
1227. ... and B. Smit (2002), Understanding Molecular Simulation: From
Algorithms to Applications, San Diego, CA: Academic Press, ... A useful book that
gives much weight to applications outside of statistical mechanics is Kalos, M. H.,
Whitlock, P. A. (1986), Monte-Carlo Methods, vol. 1, New York: John Wiley &
Sons, Inc. A more general but pedagogic introduction to computer simulation is
presented in ...

Introduction To Carbon Capture And Sequestration

Author: Berend Smit
Publisher: World Scientific
ISBN: 178326330X
Size: 61.32 MB
Format: PDF, Docs
View: 1383
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The aim of the book is to provide an understanding of the current science underpinning Carbon Capture and Sequestration (CCS) and to provide students and interested researchers with sufficient background on the basics of Chemical ...