Concepts And Methods In Modern Theoretical Chemistry Two Volume Set
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| Author | : Swapan Kumar Ghosh |
| Publisher | : CRC Press |
| Total Pages | : 856 |
| Release | : 2020-06-16 |
| Genre | : Science |
| ISBN | : 1482260689 |
Download Concepts and Methods in Modern Theoretical Chemistry, Two Volume Set Book in PDF, Epub and Kindle
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
| Author | : Swapan Kumar Ghosh |
| Publisher | : CRC Press |
| Total Pages | : 345 |
| Release | : 2016-04-19 |
| Genre | : Science |
| ISBN | : 1466506210 |
Download Concepts and Methods in Modern Theoretical Chemistry Book in PDF, Epub and Kindle
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
| Author | : Swapan Kumar Ghosh |
| Publisher | : CRC Press |
| Total Pages | : 489 |
| Release | : 2016-04-19 |
| Genre | : Science |
| ISBN | : 1466505311 |
Download Concepts and Methods in Modern Theoretical Chemistry Book in PDF, Epub and Kindle
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
| Author | : Attila Szabo |
| Publisher | : Courier Corporation |
| Total Pages | : 484 |
| Release | : 2012-06-08 |
| Genre | : Science |
| ISBN | : 0486134598 |
Download Modern Quantum Chemistry Book in PDF, Epub and Kindle
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.
| Author | : Dmitry Matyushov |
| Publisher | : World Scientific |
| Total Pages | : 373 |
| Release | : 2020-12-23 |
| Genre | : Science |
| ISBN | : 9811228914 |
Download Manual For Theoretical Chemistry Book in PDF, Epub and Kindle
This study guide aims at explaining theoretical concepts encountered by practitioners applying theory to molecular science. This is a collection of short chapters, a manual, attempting to walk the reader through two types of topics: (i) those that are usually covered by standard texts but are difficult to grasp and (ii) topics not usually covered, but are essential for successful theoretical research. The main focus is on the latter. The philosophy of this book is not to cover a complete theory, but instead to provide a set of simple study cases helping to illustrate main concepts. The focus is on simplicity. Each section is made deliberately short, to enable the reader to easily grasp the contents. Sections are collated in themed chapters, and the advantage is that each section can be studied separately, as an introduction to more in-depth studies. Topics covered are related to elasticity, electrostatics, molecular dynamics and molecular spectroscopy, which form the foundation for many presently active research areas such as molecular biophysics and soft matter physics. The notes provide a uniform approach to all these areas, helping the reader to grasp the basic concepts from a common set of theoretical tools.
| Author | : Jorge M. Seminario |
| Publisher | : Elsevier |
| Total Pages | : 863 |
| Release | : 1996-11-18 |
| Genre | : Science |
| ISBN | : 0080540392 |
Download Recent Developments and Applications of Modern Density Functional Theory Book in PDF, Epub and Kindle
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.
| Author | : Zerong Wang |
| Publisher | : John Wiley & Sons |
| Total Pages | : 4542 |
| Release | : 2017-04-17 |
| Genre | : Science |
| ISBN | : 1118470451 |
Download Encyclopedia of Physical Organic Chemistry, 6 Volume Set Book in PDF, Epub and Kindle
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
| Author | : Jack Simons |
| Publisher | : Cambridge University Press |
| Total Pages | : 484 |
| Release | : 2003-03-20 |
| Genre | : Science |
| ISBN | : 9780521530477 |
Download An Introduction to Theoretical Chemistry Book in PDF, Epub and Kindle
Textbook on modern theoretical chemistry suitable for advanced undergraduate or graduate students.
| Author | : Clifford Dykstra |
| Publisher | : Elsevier |
| Total Pages | : 1336 |
| Release | : 2011-10-13 |
| Genre | : Science |
| ISBN | : 0080456243 |
Download Theory and Applications of Computational Chemistry Book in PDF, Epub and Kindle
Computational chemistry is a means of applying theoretical ideas using computers and a set of techniques for investigating chemical problems within which common questions vary from molecular geometry to the physical properties of substances. Theory and Applications of Computational Chemistry: The First Forty Years is a collection of articles on the emergence of computational chemistry. It shows the enormous breadth of theoretical and computational chemistry today and establishes how theory and computation have become increasingly linked as methodologies and technologies have advanced. Written by the pioneers in the field, the book presents historical perspectives and insights into the subject, and addresses new and current methods, as well as problems and applications in theoretical and computational chemistry. Easy to read and packed with personal insights, technical and classical information, this book provides the perfect introduction for graduate students beginning research in this area. It also provides very readable and useful reviews for theoretical chemists. * Written by well-known leading experts * Combines history, personal accounts, and theory to explain much of the field of theoretical and compuational chemistry * Is the perfect introduction to the field
| Author | : Joseph J W McDouall |
| Publisher | : Royal Society of Chemistry |
| Total Pages | : 252 |
| Release | : 2015-11-09 |
| Genre | : Science |
| ISBN | : 1782625860 |
Download Computational Quantum Chemistry Book in PDF, Epub and Kindle
Computational Quantum Chemistry presents computational electronic structure theory as practised in terms of ab initio waveform methods and density functional approaches. Getting a full grasp of the field can often prove difficult, since essential topics fall outside of the scope of conventional chemistry education. This professional reference book provides a comprehensive introduction to the field. Postgraduate students and experienced researchers alike will appreciate Joseph McDouall's engaging writing style. The book is divided into five chapters, each providing a major aspect of the field. Electronic structure methods, the computation of molecular properties, methods for analysing the output from computations and the importance of relativistic effects on molecular properties are also discussed. Links to the websites of widely used software packages are provided so that the reader can gain first hand experience of using the techniques described in the book.
