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Computational Materials Science -

Computational Materials Science

From Basic Principles to Material Properties
Online Resource
XVI, 320 Seiten
2004
Springer Berlin (Hersteller)
9783540399155 (ISBN)
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Introduction.- Density Functional Theory and the Full-Potential Local-Orbital Approach.- Methods for Band Structure Calculations in Solids.- A Solid-State Theoretical Approach to the Optical Properties of Photonic Crystals.- Simulation of Active and Nonlinear Photonic Nanomaterials in the Finite-Difference Time-Domain Framework.- Symmetry Properties of Electronic and Photonic Band Structures.- From the Cluster to the Liquid: Ab initio Calculations on Realistic Systems Based on First-Principles Molecular Dynamics.- Magnetism, Structure and Interactions at the Atomic Scale.- Present-Day Achievements of Molecular Dynamics Simulations.- Computational Materials Science with 'Materials Studio': Applications in Catalysis.- Integration of Modelling at Various Length and Time Scales.- Simulation of Material Behaviour from the Engineering Viewpoint - Classical Approaches and New Trends.- Parallel Implementation Strategies for Algorithms from Scientific Computing.- Multi-Grid Methods - An Introduction.

Erscheint lt. Verlag 27.5.2004
Reihe/Serie Lecture Notes in Physics
Physics and Astronomy
Physics and Astronomy (R0)
Zusatzinfo XVI, 320 p. 78 illus. in color.
Verlagsort Berlin
Sprache englisch
Themenwelt Naturwissenschaften Physik / Astronomie Atom- / Kern- / Molekularphysik
Naturwissenschaften Physik / Astronomie Festkörperphysik
Schlagworte Basics • catalysis • Crystal • Design • Dynamics • Experimental Physics • liquid • magnetism • Materials properties • Materials Science • Modeling • nanotechnology • Photonics • Physics • Simulation
ISBN-13 9783540399155 / 9783540399155
Zustand Neuware
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