Conical Intersections: Electronic Structure, Dynamics & Spectroscopy

Conical Intersections: Electronic Structure, Dynamics & Spectroscopy
Author: Wolfgang Domcke
Publisher: World Scientific
Total Pages: 857
Release: 2004-07-14
Genre: Science
ISBN: 9814483753

It is widely recognized nowadays that conical intersections of molecular potential-energy surfaces play a key mechanistic role in the spectroscopy of polyatomic molecules, photochemistry and chemical kinetics. This invaluable book presents a systematic exposition of the current state of knowledge about conical intersections, which has been elaborated in research papers scattered throughout the chemical physics literature.Section I of the book provides a comprehensive analysis of the electronic-structure aspects of conical intersections. Section II shows the importance of conical intersections in chemical reaction dynamics and gives an overview of the computational techniques employed to describe the dynamics at conical intersections. Finally, Section III deals with the role of conical intersections in the fields of molecular spectroscopy and laser control of chemical reaction dynamics.This book has been selected for coverage in:• CC / Physical, Chemical & Earth Sciences• Chemistry Citation Index(tm)• Index to Scientific Book Contents® (ISBC)

Functional Dyes

Functional Dyes
Author: Sung-Hoon Kim
Publisher: Elsevier
Total Pages: 283
Release: 2006-03-08
Genre: Science
ISBN: 0080465625

In the last 10 years organic dyes, traditionally used for coloring textiles and other materials, have become increasingly important in the hi-tech industries of electronics and optoelectronics. They can be used in optical data storage, new solar cells and biomedical sensors.Functional Dyes discusses the synthesis of these new, high-value dyes and pigments as well as their applications and performance. The chapters are arranged so that the reader logically advances from the fundamental concepts to more practical aspects of the technology in which they are used.In providing the reader with current information on functional dye chemistry, as well as important developments within the field, Functional Dyes is a valuable information source for dye and material chemists, researchers and graduates, who want a summary of the key advances in the field over the last 10 years and an authoritative view on future developments.* Provides a broad introduction to the science technology of the functional dye application* Reviews recent advances on synthesis and characteristics of the functional dyes and their applications* Is a valuable information source for dye and material chemists and researchers

Electronic Structure of Polymers and Molecular Crystals

Electronic Structure of Polymers and Molecular Crystals
Author: Jean-Marie André
Publisher: Springer Science & Business Media
Total Pages: 702
Release: 2013-06-29
Genre: Science
ISBN: 1475703198

The NATO Advanced Study Institute on "Electronic Structure of Polymers and Molecular Crystals" was held at the Facultes Universi taires de Namur (F.U.N.) from September 1st till September 14th, 1974. We wish to express our appreciation to the NATO Scientific Affairs Division whose generous support made this Institute possible and to the Facultes Universitaires de Namur and the Societe Chimique de Belgique which provided fellowships and travel grants to a number of students. This volume contains the main lectures about the basic principles of the field and about different recent developments of the theory of the electronic structure of polymers and molecular crystals. The school started with the presentation of the basic SCF-LCAO theory of the electronic structure of periodic polymers and molecular crystals (contributions by Ladik, Andre & Delhalle) showing how a combination of quantum chemical and solid state physical methods can provide band structures for these systems. The numerical aspects of these calculations were also discussed. Lectures by Mahan have shown how optical properties of molecular crystals can be interpreted on the basis of the exciton theory. Little has reviewed the present status of the hypothesis about excitonic superconductivity and the different approaches to synthesize a superconductive polymer. McCubbin in his first series of lectures has given a very precise group theoretical treatment of the symmetry properties of polymers. Atkins' lectures have covered both the theoretical aspects of X-ray structure determination and its application to different polymers.

Metal-Free Synthetic Organic Dyes

Metal-Free Synthetic Organic Dyes
Author: Ghodsi Mohammadi Ziarani
Publisher: Elsevier
Total Pages: 288
Release: 2018-07-25
Genre: Science
ISBN: 0128156481

Metal- Free Synthetic Organic Dyes is a comprehensive guide to the synthetic, organic dyes that are classified by their chemical structure. As synthetic dyes are playing an increasingly important role in modern life, with applications in both industry and scientific research, this book provides insights on the many research attempts that have been made to explore new photosensitizers in the development of dye sensitized solar cells (DSCs). These novel photosensitizers have incorporated, within their structure, different organic groups, such as coumarins, cyanines, hemicyanines, indolines, triphenylamines, bis(dimethylfluorenyl) aminophenyls, phenothiazines, tetrahydroquinolines, carbazoles, polyenes, fluorenes, and many others. This comprehensive resource contains color figures and schemes for each dye discussed, and is an invaluable resource for organic, inorganic and analytical chemists working in academia and industry. - Features a discussion of the synthesis of the new, high-value synthetic dyes and pigments and their applications and performance - Includes coverage of new photosensitizers and their role in the development of dye sensitized solar cells (DSCs) - Covers synthesis of the functional dyes that are ideal for applications in the dye and pigment industry, textiles, color science, solar energy materials and solar cells, biomedical sensors, advanced materials, structure and synthesis of materials, and more

Handbook of Imaging Materials

Handbook of Imaging Materials
Author: Arthur S. Diamond
Publisher: CRC Press
Total Pages: 695
Release: 2018-10-08
Genre: Technology & Engineering
ISBN: 1482277360

"Presents the most recent developments in the materials, properties, and performance characteristics of photographic, electrophotographic, electrostatic, diazo, and ink jet imaging processes. Provides current techniques and modern applications for ink jet, thermal, and toner-related imaging systems."

Light Absorption of Organic Colorants

Light Absorption of Organic Colorants
Author: J. Fabian
Publisher: Springer Science & Business Media
Total Pages: 254
Release: 2013-11-11
Genre: Science
ISBN: 3642675875

Although studies on synthetic dyes have been performed for more than 100 years, their detailed elucidation requires further extensive research. The discovery of novel high polymers, the necessity of supplying a whole range of shades and increasing require ments for dyestuffs of high fastness properties give rise to a permanent search for new dyes. Extensive investigations on dyes were also occasioned by various applications in the field of spectral sensitization and of staining of biological specimens. Another more recent development concerns the lasing properties of some organic dyes. Most of the progress, however, was only achieved by time-consuming, purely empirical approaches and theoretical understanding of the dye properties is only at its very beginnings. The color is the sine qua non of every dye. For this reason organic chemists and color chemists have looked for relations between the "color and constitution" of dye molecules for a long time. This knowlege as a whole is known as "theory of color". The classic theory of color was established abou t 100 years ago by Witt and was signi ficantly extended 50 years later by W. Konig.

Heterocyclic Polymethine Dyes

Heterocyclic Polymethine Dyes
Author: Lucjan Strekowski
Publisher: Springer Science & Business Media
Total Pages: 248
Release: 2008-07-23
Genre: Science
ISBN: 3540790632

Heterocyclic chemistry is the biggest branch of chemistry covering two-thirds of the chemical literature and this book covers the hot topics of frontier research summarized by reputed scientists in the field.

Modeling of Molecular Properties

Modeling of Molecular Properties
Author: Peter Comba
Publisher: Wiley-VCH
Total Pages: 0
Release: 2011-10-17
Genre: Science
ISBN: 9783527330218

Molecular modeling encompasses applied theoretical approaches and computational techniques to model structures and properties of molecular compounds and materials in order to predict and / or interpret their properties. The modeling covered in this book ranges from methods for small chemical to large biological molecules and materials. With its comprehensive coverage of important research fields in molecular and materials science, this is a must-have for all organic, inorganic and biochemists as well as materials scientists interested in applied theoretical and computational chemistry. The 28 chapters, written by an international group of experienced theoretically oriented chemists, are grouped into four parts: Theory and Concepts; Applications in Homogeneous Catalysis; Applications in Pharmaceutical and Biological Chemistry; and Applications in Main Group, Organic and Organometallic Chemistry. The various chapters include concept papers, tutorials, and research reports.