Tight Binding Molecular Dynamics on Parallel Computers

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ISBN 13 :
Total Pages : 16 pages
Book Rating : 4.E/5 ( download)

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Book Synopsis Tight Binding Molecular Dynamics on Parallel Computers by : Stefan Goedecker

Download or read book Tight Binding Molecular Dynamics on Parallel Computers written by Stefan Goedecker and published by . This book was released on 1994 with total page 16 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Molecular Dynamics On Parallel Computers

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Publisher : World Scientific
ISBN 13 : 9814493554
Total Pages : 395 pages
Book Rating : 4.8/5 (144 download)

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Book Synopsis Molecular Dynamics On Parallel Computers by : Peter Grassberger

Download or read book Molecular Dynamics On Parallel Computers written by Peter Grassberger and published by World Scientific. This book was released on 2000-02-22 with total page 395 pages. Available in PDF, EPUB and Kindle. Book excerpt: Molecular dynamics is a well-established technique for simulating complex many-particle systems in many areas of physics, chemistry, and astrophysics. The huge computational requirements for simulations of large systems, especially with long-range forces, demand the use of massively parallel computers. Designing efficient algorithms for these problems is a highly non-trivial task.This book contains the invited talks and abstracts presented at a conference by more than 100 researchers from various fields: computer science, solid state physics, high energy physics, polymers, biochemistry, granular materials and astrophysics. Most of the contributions have been written by users of massively parallel computers and deal with practical issues, but there are also contributions tackling more fundamental algorithmic problems.

(O)n Parallel Tight-binding Molecular-dynamics Computer Simulation

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ISBN 13 :
Total Pages : 238 pages
Book Rating : 4.:/5 (513 download)

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Book Synopsis (O)n Parallel Tight-binding Molecular-dynamics Computer Simulation by : Cem Özdoǧan

Download or read book (O)n Parallel Tight-binding Molecular-dynamics Computer Simulation written by Cem Özdoǧan and published by . This book was released on 2002 with total page 238 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Tight Binding Electronic Structure Calculations and Tight Binding Molecular Dynamics with Localized Orbitals

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ISBN 13 :
Total Pages : 30 pages
Book Rating : 4.E/5 ( download)

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Book Synopsis Tight Binding Electronic Structure Calculations and Tight Binding Molecular Dynamics with Localized Orbitals by : Stefan Goedecker

Download or read book Tight Binding Electronic Structure Calculations and Tight Binding Molecular Dynamics with Localized Orbitals written by Stefan Goedecker and published by . This book was released on 1994 with total page 30 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Molecular Dynamics on Parallel Computers

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Publisher : World Scientific Publishing Company
ISBN 13 : 9789810242329
Total Pages : 312 pages
Book Rating : 4.2/5 (423 download)

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Book Synopsis Molecular Dynamics on Parallel Computers by : Peter Grassberger

Download or read book Molecular Dynamics on Parallel Computers written by Peter Grassberger and published by World Scientific Publishing Company. This book was released on 2000 with total page 312 pages. Available in PDF, EPUB and Kindle. Book excerpt: Molecular dynamics is a well-established technique for simulating complex many-particle systems in many areas of physics, chemistry, and astrophysics. The huge computational requirements for simulations of large systems, especially with long-range forces, demand the use of massively parallel computers. Designing efficient algorithms for these problems is a highly non-trivial task. This book contains the invited talks and abstracts presented at a conference by more than 100 researchers from various fields: computer science, solid state physics, high energy physics, polymers, biochemistry, granular materials and astrophysics. Most of the contributions have been written by users of massively parallel computers and deal with practical issues, but there are also contributions tackling more fundamental algorithmic problems.

C, H, N and O in Si and Characterization and Simulation of Materials and Processes

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Publisher : Newnes
ISBN 13 : 044459633X
Total Pages : 580 pages
Book Rating : 4.4/5 (445 download)

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Book Synopsis C, H, N and O in Si and Characterization and Simulation of Materials and Processes by : A. Borghesi

Download or read book C, H, N and O in Si and Characterization and Simulation of Materials and Processes written by A. Borghesi and published by Newnes. This book was released on 2012-12-02 with total page 580 pages. Available in PDF, EPUB and Kindle. Book excerpt: Containing over 200 papers, this volume contains the proceedings of two symposia in the E-MRS series. Part I presents a state of the art review of the topic - Carbon, Hydrogen, Nitrogen and Oxygen in Silicon and in Other Elemental Semiconductors. There was strong representation from the industrial laboratories, illustrating that the topic is highly relevant for the semiconductor industry. The second part of the volume deals with a topic which is undergoing a process of convergence with two concerns that are more particularly application oriented. Firstly, the advanced instrumentation which, through the use of atomic force and tunnel microscopies, high resolution electron microscopy and other high precision analysis instruments, now allows for direct access to atomic mechanisms. Secondly, the technological development which in all areas of applications, particularly in the field of microelectronics and microsystems, requires as a result of the miniaturisation race, a precise mastery of the microscopic mechanisms.

Molecular Dynamics Using the Tight-binding Approximation

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Publisher :
ISBN 13 : 9789514752490
Total Pages : 17 pages
Book Rating : 4.7/5 (524 download)

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Book Synopsis Molecular Dynamics Using the Tight-binding Approximation by : Riikka Virkkunen

Download or read book Molecular Dynamics Using the Tight-binding Approximation written by Riikka Virkkunen and published by . This book was released on 1991 with total page 17 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Proceedings of the Symposium on Recent Advances in the Chemistry and Physics of Fullerenes and Related Materials

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Publisher : The Electrochemical Society
ISBN 13 : 9781566770828
Total Pages : 1784 pages
Book Rating : 4.7/5 (78 download)

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Book Synopsis Proceedings of the Symposium on Recent Advances in the Chemistry and Physics of Fullerenes and Related Materials by : Karl M. Kadish

Download or read book Proceedings of the Symposium on Recent Advances in the Chemistry and Physics of Fullerenes and Related Materials written by Karl M. Kadish and published by The Electrochemical Society. This book was released on 1994 with total page 1784 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Numerical Simulation in Molecular Dynamics

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Publisher : Springer Science & Business Media
ISBN 13 : 3540680950
Total Pages : 472 pages
Book Rating : 4.5/5 (46 download)

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Book Synopsis Numerical Simulation in Molecular Dynamics by : Michael Griebel

Download or read book Numerical Simulation in Molecular Dynamics written by Michael Griebel and published by Springer Science & Business Media. This book was released on 2007-08-16 with total page 472 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book details the necessary numerical methods, the theoretical background and foundations and the techniques involved in creating computer particle models, including linked-cell method, SPME-method, tree codes, amd multipol technique. It illustrates modeling, discretization, algorithms and their parallel implementation with MPI on computer systems with distributed memory. The text offers step-by-step explanations of numerical simulation, providing illustrative code examples. With the description of the algorithms and the presentation of the results of various simulations from fields such as material science, nanotechnology, biochemistry and astrophysics, the reader of this book will learn how to write programs capable of running successful experiments for molecular dynamics.

Workshop on Molecular Dynamics on Parallel Computers

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Publisher :
ISBN 13 :
Total Pages : 379 pages
Book Rating : 4.:/5 (443 download)

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Book Synopsis Workshop on Molecular Dynamics on Parallel Computers by : Rüdiger Esser

Download or read book Workshop on Molecular Dynamics on Parallel Computers written by Rüdiger Esser and published by . This book was released on 2000 with total page 379 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Parallel Algorithms and Cluster Computing

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Publisher : Springer Science & Business Media
ISBN 13 : 3540335412
Total Pages : 365 pages
Book Rating : 4.5/5 (43 download)

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Book Synopsis Parallel Algorithms and Cluster Computing by : Karl Heinz Hoffmann

Download or read book Parallel Algorithms and Cluster Computing written by Karl Heinz Hoffmann and published by Springer Science & Business Media. This book was released on 2007-06-24 with total page 365 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents advances in high performance computing as well as advances accomplished using high performance computing. It contains a collection of papers presenting results achieved in the collaboration of scientists from computer science, mathematics, physics, and mechanical engineering. From science problems to mathematical algorithms and on to the effective implementation of these algorithms on massively parallel and cluster computers, the book presents state-of-the-art methods and technology, and exemplary results in these fields.

Annual Reviews of Computational Physics IV

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Publisher : World Scientific
ISBN 13 : 9789810227531
Total Pages : 408 pages
Book Rating : 4.2/5 (275 download)

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Book Synopsis Annual Reviews of Computational Physics IV by : Dietrich Stauffer

Download or read book Annual Reviews of Computational Physics IV written by Dietrich Stauffer and published by World Scientific. This book was released on 1996 with total page 408 pages. Available in PDF, EPUB and Kindle. Book excerpt: Quantum phenomena and methods are the core of this volume in our series which publishes rapidly reviews of topics in computational physics. In addition, we look at phase transitions in Ising lattices, in continuum fluids, polymer solutions, and end with biological ageing. As before, papers were submitted by e-mail, and these files were used directly to produce the book, for increased speed and reliability.

An Efficient Linear Scaling Algorithm for Tight Binding Molecular Dynamics

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ISBN 13 :
Total Pages : 22 pages
Book Rating : 4.E/5 ( download)

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Book Synopsis An Efficient Linear Scaling Algorithm for Tight Binding Molecular Dynamics by : Stefan Goedecker

Download or read book An Efficient Linear Scaling Algorithm for Tight Binding Molecular Dynamics written by Stefan Goedecker and published by . This book was released on 1994 with total page 22 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Molecular Dynamics Simulations on Parallel Computers

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ISBN 13 :
Total Pages : 712 pages
Book Rating : 4.:/5 (58 download)

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Book Synopsis Molecular Dynamics Simulations on Parallel Computers by : Stephen E. DeBolt

Download or read book Molecular Dynamics Simulations on Parallel Computers written by Stephen E. DeBolt and published by . This book was released on 1993 with total page 712 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Large-scale Molecular Dynamics Simulation Using Vector and Parallel Computers

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Publisher :
ISBN 13 :
Total Pages : 53 pages
Book Rating : 4.:/5 (11 download)

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Book Synopsis Large-scale Molecular Dynamics Simulation Using Vector and Parallel Computers by : Dennis C. Rapaport

Download or read book Large-scale Molecular Dynamics Simulation Using Vector and Parallel Computers written by Dennis C. Rapaport and published by . This book was released on 1988 with total page 53 pages. Available in PDF, EPUB and Kindle. Book excerpt:

High Performance Computing and Communications

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ISBN 13 :
Total Pages : 150 pages
Book Rating : 4.:/5 (3 download)

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Book Synopsis High Performance Computing and Communications by : National Science and Technology Council (U.S.). Committee on Information and Communications

Download or read book High Performance Computing and Communications written by National Science and Technology Council (U.S.). Committee on Information and Communications and published by . This book was released on 1996 with total page 150 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Polymer Science: A Comprehensive Reference

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Publisher : Newnes
ISBN 13 : 0080878628
Total Pages : 7752 pages
Book Rating : 4.0/5 (88 download)

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Book Synopsis Polymer Science: A Comprehensive Reference by :

Download or read book Polymer Science: A Comprehensive Reference written by and published by Newnes. This book was released on 2012-12-05 with total page 7752 pages. Available in PDF, EPUB and Kindle. Book excerpt: The progress in polymer science is revealed in the chapters of Polymer Science: A Comprehensive Reference, Ten Volume Set. In Volume 1, this is reflected in the improved understanding of the properties of polymers in solution, in bulk and in confined situations such as in thin films. Volume 2 addresses new characterization techniques, such as high resolution optical microscopy, scanning probe microscopy and other procedures for surface and interface characterization. Volume 3 presents the great progress achieved in precise synthetic polymerization techniques for vinyl monomers to control macromolecular architecture: the development of metallocene and post-metallocene catalysis for olefin polymerization, new ionic polymerization procedures, and atom transfer radical polymerization, nitroxide mediated polymerization, and reversible addition-fragmentation chain transfer systems as the most often used controlled/living radical polymerization methods. Volume 4 is devoted to kinetics, mechanisms and applications of ring opening polymerization of heterocyclic monomers and cycloolefins (ROMP), as well as to various less common polymerization techniques. Polycondensation and non-chain polymerizations, including dendrimer synthesis and various "click" procedures, are covered in Volume 5. Volume 6 focuses on several aspects of controlled macromolecular architectures and soft nano-objects including hybrids and bioconjugates. Many of the achievements would have not been possible without new characterization techniques like AFM that allowed direct imaging of single molecules and nano-objects with a precision available only recently. An entirely new aspect in polymer science is based on the combination of bottom-up methods such as polymer synthesis and molecularly programmed self-assembly with top-down structuring such as lithography and surface templating, as presented in Volume 7. It encompasses polymer and nanoparticle assembly in bulk and under confined conditions or influenced by an external field, including thin films, inorganic-organic hybrids, or nanofibers. Volume 8 expands these concepts focusing on applications in advanced technologies, e.g. in electronic industry and centers on combination with top down approach and functional properties like conductivity. Another type of functionality that is of rapidly increasing importance in polymer science is introduced in volume 9. It deals with various aspects of polymers in biology and medicine, including the response of living cells and tissue to the contact with biofunctional particles and surfaces. The last volume is devoted to the scope and potential provided by environmentally benign and green polymers, as well as energy-related polymers. They discuss new technologies needed for a sustainable economy in our world of limited resources. Provides broad and in-depth coverage of all aspects of polymer science from synthesis/polymerization, properties, and characterization methods and techniques to nanostructures, sustainability and energy, and biomedical uses of polymers Provides a definitive source for those entering or researching in this area by integrating the multidisciplinary aspects of the science into one unique, up-to-date reference work Electronic version has complete cross-referencing and multi-media components Volume editors are world experts in their field (including a Nobel Prize winner)