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First Principles Modelling of Shape Memory Alloys - Oliver Kastner

First Principles Modelling of Shape Memory Alloys

Molecular Dynamics Simulations

(Autor)

Buch | Softcover
XVI, 176 Seiten
2014 | 2012
Springer Berlin (Verlag)
978-3-642-44361-9 (ISBN)
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This book reviews simulation studies that model shape memory alloys. The authors utilize contemporary methodology for molecular dynamics simulation experiments to show how microscale dynamics may produce characteristic macroscopic material properties.
Materials sciences relate the macroscopic properties of materials to their microscopic structure and postulate the need for holistic multiscale research. The investigation of shape memory alloys is a prime example in this regard. This particular class of materials exhibits strong coupling of temperature, strain and stress, determined by solid state phase transformations of their metallic lattices.
The present book presents a collection of simulation studies of this behaviour. Employing conceptually simple but comprehensive models, the fundamental material properties of shape memory alloys are qualitatively explained from first principles. Using contemporary methods of molecular dynamics simulation experiments, it is shown how microscale dynamics may produce characteristic macroscopic material properties.
The work is rooted in the materials sciences of shape memory alloys and covers thermodynamical, micro-mechanical and crystallographical aspects. It addresses scientists in these research fields and their students.

Preparations.- Method.- Two 3D Examples.- 2D Lennard-Jones Crystals.- Résumée.

Erscheint lt. Verlag 20.9.2014
Reihe/Serie Springer Series in Materials Science
Zusatzinfo XVI, 176 p.
Verlagsort Berlin
Sprache englisch
Maße 155 x 235 mm
Gewicht 302 g
Themenwelt Naturwissenschaften Physik / Astronomie Atom- / Kern- / Molekularphysik
Naturwissenschaften Physik / Astronomie Festkörperphysik
Schlagworte computational research • lattice transformation thermodynamics • martensitic transformations • molecular dynamics simulations • Shape memory alloys
ISBN-10 3-642-44361-3 / 3642443613
ISBN-13 978-3-642-44361-9 / 9783642443619
Zustand Neuware
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