Overview of modern computational methods in the research of advanced materials from bulk crystals to nanoscale structures

Overview of modern computational methods in the research of advanced materials from bulk crystals to nanoscale structures
Authors: , , ,
Series: Posters
Genres: Chemistry, Computer and Information Science, Earth and Planetary Sciences, Materials Science, Mathematics, Nanotechnology and Nanomaterials, Physics, Technology
Publisher: Technicum Scientific Publishing
Publication Year: 2014

Conference Title: The 28th Molecular Modeling Workshop 2014

Date and Places: Erlangen, Germany, 17th - 19th March 2014

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About the Book

Author(s):
dr. Dejan Zagorac (1-2), prof. dr. J. Christian Schön (1), dr. Jelena Zagorac (1-2), prof. dr. Martin Jansen (1)

Affiliations:
1. Max Planck Institute for Solid State Research, Stuttgart, Germany
2. Friedrich-Alexander-Universität Erlangen-Nürnberg, Erlangen, Germany

Keywords: Crystal structure prediction, ab initio, data mining, zinc oxide (ZnO), lead sulfide (PbS)

About the Author
Zagorac Jelena

Vinča Institute of Nuclear Sciences
University of Belgrade
Serbia