Books > Professional & Technical > Mechanical engineering & materials > Materials science
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In-vitro Materials Design - Modern Atomistic Simulation Methods for Engineers (Paperback)
Loot Price: R1,703
Discovery Miles 17 030
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In-vitro Materials Design - Modern Atomistic Simulation Methods for Engineers (Paperback)
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An overview of the latest computational materials science methods
on an atomic scale. The authors present the physical and
mathematical background in sufficient detail for this highly
current and important topic, but without unnecessary complications.
They focus on approaches with industrial relevance, covering
real-life applications taken from concrete projects that range from
tribology modeling to performance optimization of integrated
circuits. Following an introduction to the fundamentals, the book
describes the most relevant approaches, covering such classical
simulation methods as simple and reactive force field methods, as
well as highly accurate quantum-mechanical methods ranging from
density-functional theory to Hartree-Fock and beyond. A review of
the increasingly important multiscale approaches rounds off this
section. The last section demonstrates and illustrates the
capabilities of the methods previously described using recent
real-life examples of industrial applications. As a result, readers
gain a heightened user awareness, since the authors clearly state
the conditions of applicability for the respective modeling methods
so as to avoid fatal mistakes.
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