02 Scientific Report 2013-2015 Impressum Vorwort
Scientific Report 2013 - 2015 Max-Planck-Institut für Eisenforschung GmbH Max-Planck-Institut für Eisenforschung GmbH Scientific Report 2013 - 2015 November 2015 Max-Planck-Institut für Eisenforschung GmbH Max-Planck-Str. 1 · 40237 Düsseldorf Germany Front cover The figure shows a snapshot of a moving grain boundary obtained by large-scale molecular dynamics simulations in the Department of Computational Materials Design. In contrast to previous studies, mesoscale features such as the migration via steps and kink sites are accurately included. The figure shows only the lower grain while atoms of the upper grain have been rendered invisible for clarity. The color indicates the height profile of the atoms. The direction normal to the grain boundary has been stretched to emphasize the step structure. Authors: Sherri Hadian, Blazej Grabowski, Jörg Neugebauer Imprint Published by Max-Planck-Institut für Eisenforschung GmbH Max-Planck-Str. 1, 40237 Düsseldorf, Germany Phone: +49-211-6792-0 Fax: +49-211-6792-440 Homepage: http://www.mpie.de Editorship, Layout and Typesetting Yasmin Ahmed Salem Katja Hübel Brigitte Kohlhaas Frank Stein Printed by Bonifatius GmbH Druck-Buch-Verlag Paderborn, Germany © November 2015 by Max-Planck-Institut für Eisenforschung GmbH, Düsseldorf All rights reserved. PREFACE This report documents the scientific activities and achievements of researchers at the Max-Planck-Institut für Eisenforschung GmbH (MPIE) between 2013 and 2015. Moreover, we present some long-term methodo- logical developments in the fields of computational materials science, advanced microstructure characteriza- tion, electrochemistry and synthesis. The mission of the MPIE lies in understanding and designing complex nanostructured materials under real environmental conditions down to the atomic and electronic scales.
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