The Future of Dynamic Structural Science

This work  focuses on complementary crystallographic and spectroscopic areas of dynamic structural science, from papers presented at the 46th NATO sponsored course in Erice, Sicily 2013. These papers cover a range of material from background concepts

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The Future of Dynamic Structural Science

Edited by Judith A.K. Howard Hazel A. Sparkes Paul R. Raithby Andrei V. Churakov

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The Future of Dynamic Structural Science

NATO Science for Peace and Security Series This Series presents the results of scientific meetings supported under the NATO Programme: Science for Peace and Security (SPS). The NATO SPS Programme supports meetings in the following Key Priority areas: (1) Defence Against Terrorism; (2) Countering other Threats to Security and (3) NATO, Partner and Mediterranean Dialogue Country Priorities. The types of meeting supported are generally "Advanced Study Institutes" and "Advanced Research Workshops". The NATO SPS Series collects together the results of these meetings. The meetings are coorganized by scientists from NATO countries and scientists from NATO’s "Partner" or "Mediterranean Dialogue" countries. The observations and recommendations made at the meetings, as well as the contents of the volumes in the Series, reflect those of participants and contributors only; they should not necessarily be regarded as reflecting NATO views or policy. Advanced Study Institutes (ASI) are high-level tutorial courses to convey the latest developments in a subject to an advanced-level audience Advanced Research Workshops (ARW) are expert meetings where an intense but informal exchange of views at the frontiers of a subject aims at identifying directions for future action Following a transformation of the programme in 2006 the Series has been re-named and re-organised. Recent volumes on topics not related to security, which result from meetings supported under the programme earlier, may be found in the NATO Science Series. The Series is published by IOS Press, Amsterdam, and Springer, Dordrecht, in conjunction with the NATO Emerging Security Challenges Division. Sub-Series A. B. C. D. E.

Chemistry and Biology Physics and Biophysics Environmental Security Information and Communication Security Human and Societal Dynamics

http://www.nato.int/science http://www.springer.com http://www.iospress.nl

Series A: Chemistry and Biology

Springer Springer Springer IOS Press IOS Press

The Future of Dynamic Structural Science edited by

Judith A.K. Howard Department of Chemistry Durham University United Kingdom

Hazel A. Sparkes School of Chemistry, University of Bristol Bristol

Paul R. Raithby Department of Chemistry University of Bath United Kingdom and

Andrei V. Churakov N.S. Kurnakov Institute of General and Inorganic Chemistry Russian Academy of Sciences Moscow, Russia

Published in Cooperation with NATO Emerging Security Challenges Division

Proceedings of the NATO Advanced Study Institute on The Future of Dynamic Structural Science: Links to Energy and Environmental Security and Early Detection of CBRN Agents Erice, Italy 30 May – 8 June 2013

Library of Congress Control Number: 2014931397

ISBN 978-94-017-8552-5 (PB) ISBN 978-94-017-8549-5 (HB) ISBN 978-94-017-8550-1 (e-book) DOI 10.1007/978-94-017-8550-1 Published by Springer, P.O. Box 17, 3300 AA Dordrecht, The