Computational Materials Science: From Ab Initio to Monte Carlo Methods (Springer Series in Solid-State Sciences)

Book Description

This book introduces new theoretical techniques in materials research. With the computer power now available, it is possible to use numerical techniques to study various physical and chemical properties of complex materials from first principles. Some typical examples are presented and all the necessary equations and plots are included so that readers can fully understand the details. This book offers the materials scientist access to, and an understanding of the modern development of molecular dynamics and Monte Carlo simulation. It will also be of interest to physicists and chemists engaged in materials research.

Customer Reviews:

Up to date but not much better than other texts.......2004-06-27

I read this book to learn more about my field of study; computational materials science. I found it thorough; it covered all the major aspects for modelling of condensed phases at the atomic scale: Monte Carlo, Moleculary Dynamics, statistical thermo, and ab initio methods.

The strong point of this book compared to others on the same subject is that the amount of space devoted to the various subjects closely corresponds to the amount of work done in those subjects. Therefore, a lot of space is spent on empirical and semi-empirical methods.

Density functional theory, which is the workhorse of today's high-end simulations, gets shorted here. Only a couple of pages are spent on it. This contrasts strongly with other books on the same subject, like the books by Raabe, or Catlow, or Finnis, where DFT gets at least a whole chapter to itself.

Likewise, there is not much on electronic structure. There are a fair number of examples in this book, but few are simple enough for the first-timer to follow. The examples tend to show of the abilities of simulations; and not the nuts and bolts of how to do them.

As such, this book is great for an introductory course on computer simulations of materials; assuming the reader has a background in materials science. It is not a good book for a course on DFT, computational quantum mechanics, or solid state calculations.

The Best MODERN treatment: Concise, yet Thorough.......2004-04-01

With an exponentially growing computational power, more precise and exact treatments of problems of condensed matter physics become affordable, and the dark corners of material science become clearly understandable. At the same time, new methods are becoming developed, that allow for better treatments of various kinds of problems in this field.

This book is a gem, written by three active frontiers on this subject and can be of great value to anyone doing computations in material science. An almost complete and up to date review of the methods used in this field with great lists of references for further studies.

Book Description

Electronic structure problems are studied in condensed matter physics and theoretical chemistry to provide important insights into the properties of matter. This graduate textbook describes the main theoretical approaches and computational techniques, from the simplest approximations to the most sophisticated methods. It starts with a detailed description of the various theoretical approaches to calculating the electronic structure of solids and molecules, including density-functional theory and chemical methods based on Hartree-Fock theory. The basic approximations are thoroughly discussed, and an in-depth overview of recent advances and alternative approaches in DFT is given. The second part discusses the different practical methods used to solve the electronic structure problem computationally, for both DFT and Hartree-Fock approaches. Adopting a unique and open approach, this textbook is aimed at graduate students in physics and chemistry, and is intended to improve communication between these communities. It also serves as a reference for researchers entering the field.

Nanoscale Phase Separation and Colossal Magnetoresistance

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Nanoscale Phase Separation and Colossal Magnetoresistance
Elbio Dagotto
Manufacturer: Springer
ProductGroup: Book
Binding: Hardcover

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ASIN: 3540432450

Book Description

The study of the spontaneous formation of nanostructures in single crystals is rapidly developing into a dominant field of research in the subject area known as strongly correlated electrons. The structures appear to originate in the competition of phases. This book addresses nanoscale phase separation, focusing on the manganese oxides with colossal magnetoresistance (CMR). The text argues that nanostructures are at the heart of the CMR phenomenon. Other compounds are also addressed, such as high-temperature superconductors, where similar nanostructures exist. Brief contributions by distinguished researchers are also included. The book contains updated information directed at experts, both theorists and experimentalists. Beginning graduate students or postdocs will also benefit from the introductory material of the early chapters, and the book can be used as a reference for an advanced graduate course.

Computational Methods in Condensed Matter: Electronic Structure (Aip Translation Series)

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Correction to Book Description

Computational Methods in Condensed Matter: Electronic Structure (Aip Translation Series)
A. A. Katsnelson , and V. S. Stepanyuk
Manufacturer: AIP Press
ProductGroup: Book
Binding: Hardcover

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ASIN: 0883188651

Book Description

This current and comprehensive treatment of the physics of small- amplitude waves in hot magnetized plasmas provides a thorough update of the author's classic Theory of Plasma Waves. New topics include quasi-linear theory, inhomogeneous plasmas, collisions, absolute and convective instability, and mode conversion. Valuable for graduates and advanced undergraduates and an indispensable reference work for researchers in plasmas, controlled fusion, and space science.

Customer Reviews:

Correction to Book Description.......2002-07-10

I have not read this book. However, I would be greatly surprised to find that condensed matter physics now includes hot magnetized plasmas as the Book Description suggests. (GUT's galore!) I saw no way in which to correct this, hence my "review." I also had to select a number of "stars," so picked the middle one. Someone please do correct me if I'm in error here, and I'll purchase this book immediately.

Computational Methods in Solid State Physics

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For grad student theorists

Computational Methods in Solid State Physics
V V Nemoshkalenko , and N.V. Antonov
Manufacturer: CRC
ProductGroup: Book
Binding: Hardcover

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ASIN: 9056990942

Book Description

The combination of theoretical physics methods, numerical mathematics and computers has given rise to a new field of physics known as "computational physics." The purpose of this monograph is to present the various methods of computational physics, in particular the methods of band theory. The first chapter of the book provides an introduction to the field and presents the theoretical foundations of band theory. In the second and third chapters the authors describe both traditional and more modern methods of band theory and include practical recommendations for their use. Methods which are discussed include APW (augmented plane wave), Green's function method, LMTO (linear method of MT- orbitals), LKKR (linear Korringer, Kohn and Rostocker method), LAPW (linear augmented plane wave), ASW (augmented spherical waves), and LASO (linear method of augmented Slater orbitals). Great attention is paid to the practical aspects of these theories and the book is structured in such a way as to enable the reader to use any method in practice without reference to other sources.

Customer Reviews:

For grad student theorists.......2004-06-19

Much of theoretical solid state physics involves heavy computational tasks. Partly because the easy, elegant, back of the envelope calculations have mostly been done. Low hanging fruit. What remains in terms of finding quantitative predictions of properties requires intensive computation.

As Nemoshkalenko points out, this is made more difficult by the very fact that we are dealing to huge multiparticle systems. Unlike, say, a treatment of a system with a few particles. So over the decades, many levels of approximate treatment have arisen, and the author describes them here. For example, modelling the potential seen at a lattice location due to its environment has given rise to such things as the muffin tin potential. Or the pseudopotential. Which is now quite respectable and well established. Unlike when it was first introduced, and some said "pseudopotential...pseudophysics".

Book Description

This invaluable book consists of 16 chapters written by some of the most notable researchers in the field of quantum Monte Carlo, highlighting the advances made since Lester Jr.'s 1997 monograph with the same title. It may be regarded as the proceedings of the Symposium on Advances in Quantum Monte Carlo Methods held during the Pacifichem meeting in December 2000, but the contributions go beyond what was presented there.

Soil Stress-Strain Behavior: Measurement, Modeling and Analysis: A Collection of Papers of the Geotechnical Symposium in Rome, March 16-17, 2006 (Solid Mechanics and Its Applications)

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Soil Stress-Strain Behavior: Measurement, Modeling and Analysis: A Collection of Papers of the Geotechnical Symposium in Rome, March 16-17, 2006 (Solid Mechanics and Its Applications)

Manufacturer: Springer
ProductGroup: Book
Binding: Hardcover

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Book Description

This book is an outgrowth of the proceedings for the Geotechnical Symposium in Roma, which was held on March 16 and 17, 2006 in Rome, Italy. The Symposium was organized to celebrate the 60th birthday of Prof. Tatsuoka as well as honoring his research achievement. The publications are focused on the recent developments in the stress-strain behavior of geomaterials, with an emphasis on laboratory measurements, soil constitutive modeling and behavior of soil structures (such as reinforced soils, piles and slopes). The latest advancement in the field, such as the rate effect and dynamic behavior of both clay and sand, behavior of modified soils and soil mixtures, and soil liquefaction are addressed. A special keynote paper by Prof. Tatsuoka is included with three other keynote papers (presented by Prof. Lo Presti, Prof. Di Benedetto, and Prof. Shibuya).

Book Description

Jesus told us that to enter into all He has for us, we must come to him as a child. So what are we, exactly, supposed to learn from those little peanut butter and jelly covered faces? Filled with hilarious and heartwarming stories about keeping our childlike wonder intact throughout life. Makes a nice birthday gift for an over-the-hill friend: just tie up with a balloon, a lollipop, and a box.

Customer Reviews:

By far the best book I've read this year!!.......1999-04-02

This book was just what the doctor ordered for this stressed out, over-worked thirty-something gal. It will have you laughing one minute, crying the next, and leave you awestruck at the realization that we really can stay young forever.

How to Re-capture Childhood Joy: 101.......1999-03-05

Becky Freeman has a way of looking at life and all its joys and heartaches in a fresh and meaningful way. She has brought this trait to her book Still Lickin' the Spoon. She shows us that no matter what life is throwing our way, we can find a reason to rejoice in the blessings in our life. She writes with humor and compassion and yes, childlike wonder. If we can all learn to look at life this way, our collective stress levels should drop dramatically. I can't wait for the next Becky Freeman book.

A fresh, light-hearted celebration of busy, modern life........1999-02-09

I am a long time Becky Freeman fan. Having read and enjoyed all her books, Still Lickin' the Spoon is my favorite to date -- also the one containing the message needed most in my own life. In this book, Becky challenged and inspired me to slow down, kick back and savor the smallest of joys. Reading her words showed me the importance of regularly putting down my To Do list, taking a deep breath and having some fun. Chapter 17, titled Jesus Is Easier to Love Than His Kids is one that I have returned to over and over again. It contains briiliant honesty, wisdom and encouragement helpful to anyone struggling with/trying to find their place in organized religion. Once again, Becky has managed to sneak in important truths between the covers a book full of joy and split-your-side humor. Still Lickin' the Spoon is a great read.

Pathetic.......1998-08-02

It should be illegal to pen a work if you have nothing meaningful to say.

The Best of Becky Freeman: Worms in My Tea and Other Mixed Blessings; Marriage 911;Still Lickin' the Spoon and Other Confessions

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The Best of Becky Freeman: Worms in My Tea and Other Mixed Blessings; Marriage 911;Still Lickin' the Spoon and Other Confessions

Manufacturer: Inspirational Press
ProductGroup: Book
Binding: Hardcover
ASIN: B000HF7FTW

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