Recent Progress in Coupled Cluster Methods: Theory and Applications (Challenges and Advances in Computational Chemistry and Physics, 11)

ISBN 10: 9048128846 ISBN 13: 9789048128846

Verlag: Springer, 2010

Sprache: Englisch

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Bibliografische Details

Titel

Recent Progress in Coupled Cluster Methods: Theory and Applications (Challenges and Advances in Computational Chemistry and Physics, 11)

Verlag

Springer

Erscheinungsjahr

2010

Sprache

Englisch

ISBN-10

9048128846

ISBN-13

9789048128846

Einband

Hardcover

Zustand

New

Verk�uferkataloge

�ber diesen Titel

Inhaltsangabe

I feel very honored that I have been asked to write a Foreword to this book. The subject of the book - "Coupled cluster theory" - has been around for about half a century. The basic theory and explicit equations for closed-shell ground states were formulated before 1970. At the beginning of the seventies the rst ab initio calcu- tion were carried out. At that time speed and memory of computers were very limited compared to today's standards. Moreover, the size of one-electron bases employed was small, so that it was only possible to achieve an orientation in methodical aspects rather than to generate new signi cant results. Extensive use of the coupled-cluster method started at the beginning of the eighties. With the help of more powerful computers the results of coupled-cluster approaches started to yield more and more interesting results of relevance to the interpretation of experimental data. New ideas in methodology kept appearing and computer codes became more and more ef cient. This exciting situation continues to this very day. Remarkably enough, even the - quired equations can now be generated by a computer with the help of symbolic languages. The size of this monograph and the rich variety of articles it contains attests to the usefulness and viability of the couple-cluster formalism for the h- dling of many-electron correlation effects. This represents a vivid testimony of a tremendous work that has been accomplished in coupled-cluster methodology and its exploitation.

�ber die Autorin bzw. den Autor

P. C�rsky is a Senior Scientist at the Heyrovsk� Institute and external professor at the Charles University

J. Paldus is a Distinguished Professor Emeritus at the University of Waterloo, Canada

J. Pittner is the Head of the Department of Theoretical Chemistry at the Heyrovsk� Institute

P. C�rsky was a coauthor of the following books:

R. Zahradn�k, P. C�rsky: Organic Quantum Chemistry Problems. Plenum Press, New York 1973, 222 p.

New editions:

Hirokawa Publishing Company, Tokyo, 1979 (in Japanese), SNTL, Praha 1978 (in Czech).

R. Zahradn�k, P. C�rsky: Sb�rka �loh z aplikac� kvantov� chemie. Statn� pedagogick� nakladatelstv�, Praha 1967, 174 p (in Czech).

P. Hobza, P. C�rsky, J. Panc�r, R. Zahradn�k: V�klad k programum pro kvantove chemick� v�pocty. St�tn� pedagogick� nakladatelstv�, Praha 1972, 140 p (in Czech).

P. C�rsky, J. Panc�r, R. Zahradn�k: Molekulov� orbitaly v chemii. Academia, Praha 1974, 140 p (in Czech).

P. C�rsky, M. Urban: Ab Initio Calculations. Methods and Applications in Chemistry. Lecture Notes in Chemistry, Vol. 18. Springer-Verlag, Berlin 1980, 247 p.

Czech edition: Ab initio v�pocty v chemii. SNTL, Praha 1985, 279 p. J. Paldus contributed numerous Chapters to various monographs and is currently on several Editorial Boards (in particular for a book series "Advances in Quantum Chemistry" published by Academic Press).

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