Atomistic Modeling of Materials Failure
Title | Atomistic Modeling of Materials Failure PDF eBook |
Author | Markus J. Buehler |
Publisher | |
Total Pages | 560 |
Release | 2011-03-21 |
Genre | |
ISBN | 9780387567709 |
Atomistic Modeling of Materials Failure
Title | Atomistic Modeling of Materials Failure PDF eBook |
Author | Markus J. Buehler |
Publisher | Springer Science & Business Media |
Total Pages | 547 |
Release | 2008-08-07 |
Genre | Science |
ISBN | 0387764267 |
This is an introduction to molecular and atomistic modeling techniques applied to fracture and deformation of solids, focusing on a variety of brittle, ductile, geometrically confined and biological materials. The overview includes computational methods and techniques operating at the atomic scale, and describes how these techniques can be used to model cracks and other deformation mechanisms. The book aims to make new molecular modeling techniques available to a wider community.
Atomistic Computer Simulations
Title | Atomistic Computer Simulations PDF eBook |
Author | Veronika Brázdová |
Publisher | John Wiley & Sons |
Total Pages | 291 |
Release | 2013-04-16 |
Genre | Science |
ISBN | 3527671838 |
Many books explain the theory of atomistic computer simulations; this book teaches you how to run them This introductory "how to" title enables readers to understand, plan, run, and analyze their own independent atomistic simulations, and decide which method to use and which questions to ask in their research project. It is written in a clear and precise language, focusing on a thorough understanding of the concepts behind the equations and how these are used in the simulations. As a result, readers will learn how to design the computational model and which parameters of the simulations are essential, as well as being able to assess whether the results are correct, find and correct errors, and extract the relevant information from the results. Finally, they will know which information needs to be included in their publications. This book includes checklists for planning projects, analyzing output files, and for troubleshooting, as well as pseudo keywords and case studies. The authors provide an accompanying blog for the book with worked examples, and additional material and references: http://www.atomisticsimulations.org/.
Atomistic Simulation of Anistropic Crystal Structures at Nanoscale
Title | Atomistic Simulation of Anistropic Crystal Structures at Nanoscale PDF eBook |
Author | Jia Fu |
Publisher | BoD – Books on Demand |
Total Pages | 180 |
Release | 2019-05-10 |
Genre | Computers |
ISBN | 1838802010 |
Multiscale simulations of atomistic/continuum coupling in computational materials science, where the scale expands from macro-/micro- to nanoscale, has become a hot research topic. These small units, usually nanostructures, are commonly anisotropic. The development of molecular modeling tools to describe and predict the mechanical properties of structures reveals an undeniable practical importance. Typical anisotropic structures (e.g. cubic, hexagonal, monoclinic) using DFT, MD, and atomic finite element methods are especially interesting, according to the modeling requirement of upscaling structures. It therefore connects nanoscale modeling and continuous patterns of deformation behavior by identifying relevant parameters from smaller to larger scales. These methodologies have the prospect of significant applications. I would like to recommend this book to both beginners and experienced researchers.
Damage and Failure of Composite Materials
Title | Damage and Failure of Composite Materials PDF eBook |
Author | Ramesh Talreja |
Publisher | Cambridge University Press |
Total Pages | 315 |
Release | 2012-06-07 |
Genre | Science |
ISBN | 0521819423 |
Bringing together materials mechanics and modelling, this book provides a complete guide to damage mechanics of composite materials for engineers.
Heterogeneous Materials
Title | Heterogeneous Materials PDF eBook |
Author | Muhammad Sahimi |
Publisher | Springer Science & Business Media |
Total Pages | 650 |
Release | 2003-05-15 |
Genre | Language Arts & Disciplines |
ISBN | 0387001662 |
This monograph describes and discusses the properties of heterogeneous materials, comparing two fundamental approaches to describing and predicting materials’ properties. This multidisciplinary book will appeal to applied physicists, materials scientists, chemical and mechanical engineers, chemists, and applied mathematicians.
Forcefields for Atomistic-Scale Simulations: Materials and Applications
Title | Forcefields for Atomistic-Scale Simulations: Materials and Applications PDF eBook |
Author | Akarsh Verma |
Publisher | Springer Nature |
Total Pages | 395 |
Release | 2022-08-19 |
Genre | Technology & Engineering |
ISBN | 9811930929 |
This book describes the forcefields/interatomic potentials that are used in the atomistic-scale and molecular dynamics simulations. It covers mechanisms, salient features, formulations, important aspects and case studies of various forcefields utilized for characterizing various materials (such as nuclear materials and nanomaterials) and applications. This book gives many help to students and researchers who are studying the forcefield potentials and introduces various applications of atomistic-scale simulations to professors who are researching molecular dynamics.