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Author: Takashiro Akitsu Publisher: BoD – Books on Demand ISBN: 1789851556 Category : Science Languages : en Pages : 130
Book Description
In chemistry, biology, and physics, "chirality" is an important concept in nature. Especially in chemistry, not only classical stereochemistry but also asymmetric organic synthesis, supramolecular chemistry, construction of bio-related molecules and molecular recognition became indispensable structural chemical keywords. However, in view of synthetic chemistry and its structural chemistry, chemistry dealing with chirality in relation to the more fundamental electronic state is still a minority. This book is particularly aimed at chiroptical spectroscopy, structural or physical features and theoretical computation of chirality.
Author: Takashiro Akitsu Publisher: BoD – Books on Demand ISBN: 1789851556 Category : Science Languages : en Pages : 130
Book Description
In chemistry, biology, and physics, "chirality" is an important concept in nature. Especially in chemistry, not only classical stereochemistry but also asymmetric organic synthesis, supramolecular chemistry, construction of bio-related molecules and molecular recognition became indispensable structural chemical keywords. However, in view of synthetic chemistry and its structural chemistry, chemistry dealing with chirality in relation to the more fundamental electronic state is still a minority. This book is particularly aimed at chiroptical spectroscopy, structural or physical features and theoretical computation of chirality.
Author: Takashiro Akitsu Publisher: ISBN: 9781789851564 Category : Chemistry, Organic Languages : en Pages : 128
Book Description
In chemistry, biology, and physics, ""chirality"" is an important concept in nature. Especially in chemistry, not only classical stereochemistry but also asymmetric organic synthesis, supramolecular chemistry, construction of bio-related molecules and molecular recognition became indispensable structural chemical keywords. However, in view of synthetic chemistry and its structural chemistry, chemistry dealing with chirality in relation to the more fundamental electronic state is still a minority. This book is particularly aimed at chiroptical spectroscopy, structural or physical features and theoretical computation of chirality.
Author: Trygve Helgaker Publisher: John Wiley & Sons ISBN: 1119019559 Category : Science Languages : en Pages : 949
Book Description
Ab initio quantum chemistry has emerged as an important tool in chemical research and is appliced to a wide variety of problems in chemistry and molecular physics. Recent developments of computational methods have enabled previously intractable chemical problems to be solved using rigorous quantum-mechanical methods. This is the first comprehensive, up-to-date and technical work to cover all the important aspects of modern molecular electronic-structure theory. Topics covered in the book include: * Second quantization with spin adaptation * Gaussian basis sets and molecular-integral evaluation * Hartree-Fock theory * Configuration-interaction and multi-configurational self-consistent theory * Coupled-cluster theory for ground and excited states * Perturbation theory for single- and multi-configurational states * Linear-scaling techniques and the fast multipole method * Explicity correlated wave functions * Basis-set convergence and extrapolation * Calibration and benchmarking of computational methods, with applications to moelcular equilibrium structure, atomization energies and reaction enthalpies. Molecular Electronic-Structure Theory makes extensive use of numerical examples, designed to illustrate the strengths and weaknesses of each method treated. In addition, statements about the usefulness and deficiencies of the various methods are supported by actual examples, not just model calculations. Problems and exercises are provided at the end of each chapter, complete with hints and solutions. This book is a must for researchers in the field of quantum chemistry as well as for nonspecialists who wish to acquire a thorough understanding of ab initio molecular electronic-structure theory and its applications to problems in chemistry and physics. It is also highly recommended for the teaching of graduates and advanced undergraduates.
Author: Takashiro Akitsu Publisher: BoD – Books on Demand ISBN: 1839689536 Category : Science Languages : en Pages : 198
Book Description
Chirality is a concept related not only to organic chemistry but also to each field of natural science. Awareness of hierarchy is important for universal and comprehensive understanding. As such, this book examines myriad subjects related to chirality in chemistry and interdisciplinary applications. In contrast to the previous book, this new book about chirality includes contributions from authors in many fields of natural science, providing a wider overview. The book’s focus is chirality and organic chemistry, including synthesis and reactions.
Author: Imran Ali Publisher: John Wiley & Sons ISBN: 0470867817 Category : Science Languages : en Pages : 368
Book Description
Today, among the various chiral discrimination methods, chromatography and capillary electrophoresis techniques have become powerful tools in environmental analysis. Therefore, there is a need to describe the art of the determination of the chiral pollutants in the environmental matrices. This book provides the complete information on the types of the chiral pollutants, their toxicities and methods of determination by chromatography and capillary electrophoresis.
Author: Paul G. Mezey Publisher: Springer Science & Business Media ISBN: 940113698X Category : Science Languages : en Pages : 296
Book Description
Molecular chirality is one of the fundamental aspects of chemistry. Chirality properties of molecules have implications in a wide variety of subjects, ranging from the basic quantum mechanical properties of simple of a few atoms to molecular optical activity, asymmetric synthesis, systems and the folding pattern of proteins. Chirality, in both the geometrical and the topological sense, has also been the subject of investigations in various branches of mathematics. In particular, new developments in a branch of topology, called knot theory, as well as in various branches of discrete mathematics, have led to a novel perspective on the topological aspects of molecular chirality. Some of the mathematical advances have already found applications to the interpretation of new concepts in theoretical chemistry and mathematical chemistry, as well as to novel synthetic approaches leading to new molecules of exceptional structural properties. Some of the new developments in molecular chirality have been truly fundamental to the theoretical understanding and to the actual practice of many aspects of chemistry. The progress in this field has been very rapid, even accelerating in recent years, and a review appears more than justified. This book offers a selection of subjects covering some of the latest developments. Our primary aim is to clarify some of the basic concepts that are the most prone to misinterpretation and to provide brief introductions to some of those subjects that are expected to have further, important contributions to our understanding of molecular properties and chemical reactivity.
Author: Stephen F. Mason Publisher: Cambridge University Press ISBN: 9780521247023 Category : Medical Languages : en Pages : 300
Book Description
Good,No Highlights,No Markup,all pages are intact, Slight Shelfwear,may have the corners slightly dented, may have slight color changes/slightly damaged spine.
Author: Ron Naaman Publisher: Springer ISBN: 364218104X Category : Science Languages : en Pages : 323
Book Description
Time-dependent density functional response theory for electronic chiroptical properties of chiral molecules; by Jochen Autschbach, Lucia Nitsch–Velasquez, and Mark Rudolph * Chiroptical Properties of Charge-Transfer Compounds; by Yoshihisa Inoue, Tadashi Mori * G-C content independent long-range charge transfer through DNA; by Tetsuro Majima * Induced chirality in porphiryn aggregates: the role of weak and strong interactions; by Roberto Purrello * Vibrational circular dichroism spectroscopy of chiral molecules in solution; by Yunjie Xu * Magneto-electric properties of self-assembled monolayers of chiral molecules; by Zeev Vager and Ron Naaman * Theory of adsorption induced chirality and electron transfer through chiral systems; by Spiros Skourtis and David Beratan * Chiral-selective surface chemistry induced by spin-polarized secondary electrons; by Richard Rosenberg
Author: Kaoru Yamanouchi Publisher: Springer Nature ISBN: 3030750892 Category : Science Languages : en Pages : 232
Book Description
This book covers a broad range of topics from the interdisciplinary research field of ultrafast intense laser science, focusing on atoms and molecules interacting with intense laser fields, laser-induced filamentation, high-order harmonics generation, and high power lasers and their applications. This sixteenth volume features contributions from world-renowned researchers, introducing the latest reports on probing molecular chirality with intense laser fields, and the most recent developments in the Shanghai Superintense Ultrafast Laser Facility project. The PUILS series delivers up-to-date reviews of progress in this emerging interdisciplinary research field, spanning atomic and molecular physics, molecular science, and optical science, which has been stimulated by the recent developments in ultrafast laser technologies. Each volume compiles peer-reviewed articles authored by researchers at the forefront of each of their own subfields of ultrafast intense laser science. Every chapter opens with an overview of the topics to be discussed, so that researchers unfamiliar to the subfield, especially graduate students, can grasp the importance and attractions of the research topic at hand; these are followed by reports of cutting-edge discoveries.
Author: Takashiro Akitsu
Author: Takashiro Akitsu
Author: Takashiro Akitsu
Author: Trygve Helgaker
Author: G. Del Re
Author: Takashiro Akitsu
Author: Imran Ali
Author: Paul G. Mezey
Author: Stephen F. Mason
Author: Ron Naaman
Author: Kaoru Yamanouchi