Multiscale kinetic modelling of materials : proceedings of the symposium "Multiscale Kinetic Modelling of Materials", organised within the EMRS Fall Meeting 2006 held in Warsaw, Poland, 4-8 September 2006 / edited by R. Kozubski, G.E. Murch and P. Zięba.

Format:

Book

Contributor:

Kozubski, Rafał, 1955-

Murch, G. E.

Zięba, Paweł.

Series:

Diffusion and defect data. Solid state phenomena ; Pt. B, v. 129.

Diffusion and defect data. Pt. B. Solid state phenomena, 1012-0394 ; volume 129

Language:

English

Subjects (All):

Kinetic theory of matter--Congresses.

Kinetic theory of matter.

Materials--Analysis--Congresses.

Materials.

Mathematical models--Congresses.

Mathematical models.

Physical Description:

1 online resource (171 p.)

Edition:

1st ed.

Place of Publication:

Stafa-Zuerich : Trans Tech Publications, [2007]

Language Note:

English

Summary:

The inspiration for this book was to gather together the efforts of those physicists, materials scientists/engineers and other scientists who are carrying out interdisciplinary research into multiscale modelling of time-evolving phenomena in materials. The resultant collection focuses on the principal topics of: 1. The current development of theoretical and model approaches to structural kinetics (links between quantum electron theories of solids and non-equilibrium thermodynamics); 2. Computer simulations as an effective tool for studying atomistic mechanisms of structural kinetics (Monte Car

Contents:

MULTISCALE KINETIC MODELLING OF MATERIALS; Participants; Committees; Preface; Table of Contents; Bridging Different Length and Time Scales in Diffusion Problems Using a Lattice Monte Carlo Method ; Electro-Mechano-Chemistry; Transport Problem in Four Time Scales ; Concurrent Multiscale Kinetic Monte Carlo-Continuum Models for the Evolution of Solids via Diffusion ; Comparison of the Strain Distribution Obtained from Multi Scale and Conventional Approaches to Modelling Extrusion ; Energetic Landscapes and Diffusion Properties in FeCu Alloys

Multi-Lattice Kinetic Monte Carlo Simulation of Interface Controlled Solid-State Transformations Cluster Dynamics Modeling of Materials: Advantages and Limitations; Interdiffusion of Two L10Phases without Long-Range Order Decrease: Experiments and Molecular Dynamics Simulations; Orientation of Interstitials in Clusters in α-Fe: A Comparison between Empirical Potentials ; Anisotropy of the Vacancy Migration in Ti, Zr and Hf Hexagonal Close-Packed Metals from First Principles ; Monte Carlo Simulation of Texture and Microstructure Transformation during Annealing of Steel

A Phase Field Model for grain Growth and Thermal Grooving in Thin Films with Orientation Dependent Surface Energy An Extensive Study of Charge Effects in Silicon Doped Heterofullerenes ; Interface Shape Change and Shift Kinetics on the Nanoscale; Analysis of Oxygen Segregation at Metal-Oxide Interfaces Using a New Lattice Monte Carlo Method ; Materials Hardness Estimation by Simulation of the Indentation Process ; Stability of Hollow Nanospheres: A Molecular Dynamics Study ; First Principles Study of Al(100) Twisted Interfaces

Interface Dynamics of Melt Instabilities on Semiconductor Surface Grain Boundary Migration in Nanocrystalline Iron ; Mutiscale Plastic Deformation near a Fatigue Crack from Diffraction ; Statistical Model of Grain Growth in Polycrystalline Nanomaterials ; Keywords Index; Authors Index

Notes:

Conference proceedings.

Includes bibliographical references and indexes.

Description based on print version record.

ISBN:

3-03813-142-3

OCLC:

897070461