Concepts and Methods in Modern Theoretical Chemistry, Two Volume Set

Concepts and Methods in Modern Theoretical Chemistry, Two Volume Set PDF

Author: Swapan Kumar Ghosh

Publisher: CRC Press

Published: 2020-06-16

Total Pages: 856

ISBN-13: 1482260689

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Concepts and Methods in Modern Theoretical Chemistry, Two-Volume Set focuses on the structure and dynamics of systems and phenomena. A new addition to the series Atoms, Molecules, and Clusters, the two books offer chapters written by experts in their fields. They enable readers to learn how concepts from ab initio quantum chemistry, density functio

Concepts and Methods in Modern Theoretical Chemistry

Concepts and Methods in Modern Theoretical Chemistry PDF

Author: Swapan Kumar Ghosh

Publisher: CRC Press

Published: 2016-04-19

Total Pages: 489

ISBN-13: 1466505311

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Concepts and Methods in Modern Theoretical Chemistry: Electronic Structure and Reactivity, the first book in a two-volume set, focuses on the structure and reactivity of systems and phenomena. A new addition to the series Atoms, Molecules, and Clusters, this book offers chapters written by experts in their fields. It enables readers to learn how co

Concepts and Methods in Modern Theoretical Chemistry

Concepts and Methods in Modern Theoretical Chemistry PDF

Author: Swapan Kumar Ghosh

Publisher: CRC Press

Published: 2016-04-19

Total Pages: 345

ISBN-13: 1466506210

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Concepts and Methods in Modern Theoretical Chemistry: Statistical Mechanics, the second book in a two-volume set, focuses on the dynamics of systems and phenomena. A new addition to the series Atoms, Molecules, and Clusters, this book offers chapters written by experts in their fields. It enables readers to learn how concepts from ab initio quantum

Modern Quantum Chemistry

Modern Quantum Chemistry PDF

Author: Attila Szabo

Publisher: Courier Corporation

Published: 2012-06-08

Total Pages: 480

ISBN-13: 0486134598

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This graduate-level text explains the modern in-depth approaches to the calculation of electronic structure and the properties of molecules. Largely self-contained, it features more than 150 exercises. 1989 edition.

Encyclopedia of Physical Organic Chemistry, 6 Volume Set

Encyclopedia of Physical Organic Chemistry, 6 Volume Set PDF

Author: Zerong Wang

Publisher: John Wiley & Sons

Published: 2017-04-17

Total Pages: 4542

ISBN-13: 1118470451

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Winner of 2018 PROSE Award for MULTIVOLUME REFERENCE/SCIENCE This encyclopedia offers a comprehensive and easy reference to physical organic chemistry (POC) methodology and techniques. It puts POC, a classical and fundamental discipline of chemistry, into the context of modern and dynamic fields like biochemical processes, materials science, and molecular electronics. Covers basic terms and theories into organic reactions and mechanisms, molecular designs and syntheses, tools and experimental techniques, and applications and future directions Includes coverage of green chemistry and polymerization reactions Reviews different strategies for molecular design and synthesis of functional molecules Discusses computational methods, software packages, and more than 34 kinds of spectroscopies and techniques for studying structures and mechanisms Explores applications in areas from biology to materials science The Encyclopedia of Physical Organic Chemistry has won the 2018 PROSE Award for MULTIVOLUME REFERENCE/SCIENCE. The PROSE Awards recognize the best books, journals and digital content produced by professional and scholarly publishers. Submissions are reviewed by a panel of 18 judges that includes editors, academics, publishers and research librarians who evaluate each work for its contribution to professional and scholarly publishing. You can find out more at: proseawards.com Also available as an online edition for your library, for more details visit Wiley Online Library

Theoretical Chemistry: Volume 2

Theoretical Chemistry: Volume 2 PDF

Author: R. N. Dixon

Publisher: Royal Society of Chemistry

Published:

Total Pages: 224

ISBN-13: 0851867642

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This product is not available separately, it is only sold as part of a set. There are 750 products in the set and these are all sold as one entity.

Quantum-Chemical Calculation of Unique Molecular Systems, Two-Volume Set

Quantum-Chemical Calculation of Unique Molecular Systems, Two-Volume Set PDF

Author: Vladimir A. Babkin

Publisher: CRC Press

Published: 2014-02-25

Total Pages: 674

ISBN-13: 148222433X

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The major goals of quantum chemistry include increasing the accuracy of the results for small molecular systems and increasing the size of large molecules that can be processed, which is limited by scaling considerations—the computation time increases as a power of the number of atoms. This book offers scope for academics, researchers, and engineering professionals to present their research and development works that have potential for applications in several disciplines of computational chemistry. Contributions range from new methods to novel applications of existing methods to gain an understanding of the concepts.

Recent Developments and Applications of Modern Density Functional Theory

Recent Developments and Applications of Modern Density Functional Theory PDF

Author: Jorge M. Seminario

Publisher: Elsevier

Published: 1996-11-18

Total Pages: 863

ISBN-13: 0080540392

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The present status of Density Functional Theory (DFT), which has evolved as the main technique for the study of matter at the atomistic level, is described in this volume. Knowing the behavior of atoms and molecules provides a sure avenue for the design of new materials with specific features and properties in many areas of science and technology. A technique based on purely first principles allowing large savings in time and money greatly benefits the specialist or designer of new materials. The range of areas where DFT is applied has expanded and continues to do so. Any area where a molecular system is the center of attention can be studied using DFT.The scope of the 22 chapters in this book amply testifies to this.