The exceptional quality of previous editions has been built upon to make the twelfth edition of Atkins' Physical Chemistry even more closely suited to the needs of both lecturers and students. The writing style has been refreshed in collaboration with current students of physical chemistry in order to retain the clarity for which the book is recognised while mirroring the way you read and engage with information. The new edition is now available as an enhanced e-book, which offers you a richer, more dynamic learning experience. It does this by incorporating digital enhancements that are carefully curated and thoughtfully inserted at meaningful points to enhance the learning experience. In addition, it offers formative auto-graded assessment materials to provide you with regular opportunities to test their understanding. Digital enhancements introduced for the new edition include dynamic graphs, which you can interact with to explore how the manipulation of variables affects the results of the graphs; self-check questions at the end of every Topic; video content from physical chemists; and video tutorials to accompany each Focus, which dig deeper into the key equations introduced. There is also a new foundational prologue entitled 'Energy: A First Look', which summarizes key concepts that are best kept in mind right from the beginning of your physical chemistry studies. The coupling of the broad coverage of the subject with a structure and use of pedagogy that is even more innovative will ensure Atkins' Physical Chemistry remains the textbook of choice for studying physical chemistry.

Boron-Doped Diamond Electrodes for Electroorganic Chemistry, by Siegfried R. Waldvogel, Stamo Mentizi und Axel Kirste.- Modern Developments in Aryl Radical Chemistry, by Gerald Pratsch und Markus R. Heinrich.- Radical Additions to Chiral Hydrazones: Stereoselectivity and Functional Group Compatibility, by Gregory K. Friestad.- Hydrogen Atom Donors: Recent Developments, by Andreas Gansauer, Lei Shi, Matthias Otte, Inga Huth, Antonio Rosales, Iris Sancho-Sanz, Natalia M. Padial und J. Enrique Oltra.- Radicals in Transition Metal Catalyzed Reactions? Transition Metal Catalyzed Radical Reactions? - A Fruitful Interplay Anyway Part 1. Radical Catalysis by Group 4 to Group 7 Elements, by Ullrich Jahn.- Radicals in Transition Metal Catalyzed Reactions? Transition Metal Catalyzed Radical Reactions? - A Fruitful Interplay Anyway Part 2. Radical Catalysis by Group 8 and 9 Elements, by Ullrich Jahn.- Radicals in Transition Metal Catalyzed Reactions? Transition Metal Catalyzed Radical Reactions?: A Fruitful Interplay Anyway Part 3: Catalysis by Group 10 and 11 Elements and Bimetallic Catalysis, by Ullrich Jahn.-"

Synchrotron Techniques in Interfacial Chemistry covers the structure of the electrode--solution interface and surface films, theory of X-ray scattering at surfaces and interfaces, synchrotron radiation instrumentation, surface X-ray diffraction, X-ray reflectivity, X-ray absorption spectroscopy (EXAFS and XANES), standing wave techniques, and IR spectroscopy. The use of each technique in the study of electrochemical problems is illustrated.

This book presents an original investigation into alternative photovoltaic absorbers. Solar power is a highly promising renewable energy solution; however, its success is hampered by the limited cost-effectiveness of current devices. The book assesses the photovoltaic performance of over 20 materials using state-of-the-art, first-principles methods. Adopting a computational approach, it investigates atomic-scale properties at a level of accuracy that is difficult to achieve using laboratory-based experimental techniques. Unlike many theoretical studies, it provides specific advice to those involved in experimental investigations. Further, it proposes directions for future research. This book advances the field of photovoltaics in three crucial ways: firstly, it identifies why one class of proposed materials cannot achieve high efficiency, while at the same time gaining insights that can be used to design future absorbers. Secondly, it shows that poor performance in the bismuth chalcohalides is not due to fundamental limitations, and can be overcome by finely controlling synthesis conditions. Lastly, it describes a range of new stable materials that are expected to show excellent photovoltaic performance.

Almost all contemporary organic synthesis involve transition metal complexes as catalysts or particular reagents. The aim of this book is to provide the reader with detailed accounts of elementary processes within molecular catalysis to allow its development and as an aid in designing novel catalytic systems. The book comprises authoritative reviews on elementary processes from experts working at the forefront of organometallic chemistry.
.This is the first book that focuses on elementary processes in transition metal complexes for understanding catalytic mechanisms
.Provides detailed description of elementary processes involved in catalytic cycles by experts in the field
.Provides an overview of the mechanisms of various homogeneous catalyses

This book presents numerous uses of biosurfactants as potential alternatives to synthetic surfactants in food, textile, biomedical and therapeutic applications as well as in bioremediation and waste management. Divided into four parts, the book explores a wide range of biosurfactants as sustainable materials, starting with an overview of biosurfactants' production, in which readers will find topics such as characterization, purification, sustainable production, biodegradation, and cytotoxic aspects of biosurfactants. Part 2 presents the latest applications of biosurfactants in food and textile industries, as well as their application in nanoparticle synthesis, heavy metal remediation, drug absorption, waste treatment, agriculture management, marine sediment remediation of organic pollutants, emulsification and biofuel production, and as anti-corrosive agents. Part 3 traces current biomedical applications of biosurfactants, including their use as biocidal, wound healing, and anti-tumour agents. In this part, readers will also discover further applications of biosurfactants in oral cavity care, and biofilm prevention and disruption. The final part of the book discusses the main advantages and disadvantages of biosurfactants over synthetic surfactants, the current challenges in biosurfactant research, and prospects for their commercialization. This book will be a valuable resource for students, scholars and researchers working in the fields of colloidal and interface science, chemistry and chemical engineering. Professionals and scholars alike will appreciate the latest research findings that it presents.

Separation technologies are of crucial importance to the goal of significantly reducing the volume of high-level nuclear waste, thereby reducing the long-term health risks to mankind. International co-operation, including the sharing of concepts and methods, as well as technology transfer, is essential in accelerating research and development in the field.

The writers of this book are all internationally recognised experts in the field of separation technology, well qualified to assess and criticize the current state of separation research as well as to identify future opportunities for the application of separation technologies to the solution of nuclear waste management problems. The major emphases in the book are research opportunities in the utilization of innovative and potentially more efficient and cost effective processes for waste processing/treatment, actinide speciation/separation methods, technological processing, and environmental restoration.

This volume covers both basic and advanced aspects of organometallic chemistry of all metals and catalysis. In order to present a comprehensive view of the subject, it provides broad coverage of organometallic chemistry itself. The catalysis section includes the challenging activation and fictionalization of the main classes of hydrocarbons and the industrially crucial heterogeneous catalysis. Summaries and exercises are provides at the end of each chapter, and the answers to these exercises can be found at the back of the book. Beginners in inorganic, organic and organometallic chemistry, as well as advanced scholars and chemists from academia and industry will find much value in this title.

Surface engineering is an increasingly important field and consequently those involved need to be aware of the vast range of technologies available to modify surfaces. This text provides an up-to-date, authoritative exposition of the major condensed phase methods used for producing metallurgical and ceramic coatings. Each method is discussed thoroughly by an expert in that field. In each chapter the principle of the method, its range of applications and technical aspects involved are described. The book not only informs the reader about established technologies familiar only to specialists, but also details activity on the frontier of coating technology providing an insight into those potential technologies not yet fully developed but which should emerge in the near future.

Oxygenases have been the subject of much study and are of great interest and application. Biomimetic chemistry of oxygenases has yielded clarification of enzyme structures and reaction mechanisms and has also led to the development of synthetic oxygenation processes. This volume contains 8 chapters written by leading researchers which together present an overview of di- and mono-oxygenases and their model systems from the point of view of functions, structures and mechanisms. An up-to-date clarification of structures around active centres of heme- and nonheme-oxygenases is given with reference to the design of model complexes. Various contributions also discuss in detail the formation, structure and reactivity of metal-oxygen and metal-substrate species in both enzyme and model systems. The contents of the volume address the interface between bioinorganic chemistry and homogeneous catalysis and contains much to emphasize the importance of catalytic studies in bio- and biomimetic chemistry. Audience: Research chemists interested in the use of oxygenases in catalysis.

Microemulsions and gels are well-known systems, which play a major role in colloidal and interfacial science. In contrast, the concept of gel microemulsions is still quite new. Gelled microemulsions are highly promising for microemulsion applications in which low viscosity is undesirable, such as administering a drug-delivering microemulsion to a certain area of the skin. It is essential to understand the properties of and structures formed in a system combining microemulsion components and a gelator. This PhD thesis by Michaela Laupheimer provides an in-depth discussion of the phase behavior and sol-gel transition of a microemulsion gelled by a low molecular weight gelator as well as the rheological behavior of a gelled bicontinuous microemulsion. Moreover, the microstructure of the gelled bicontinuous system is fully clarified using techniques like self-diffusion NMR and small angle neutron scattering (SANS). By comparing gelled bicontinuous microemulsions with corresponding non-gelled microemulsions and binary gels, it is demonstrated that bicontinuous microemulsion domains coexist with a gelator network and that the coexisting structures possess no fundamental mutual influence. Hence, gelled bicontinuous microemulsions have been identified as a new type of orthogonal self-assembled system.

Prof. Baev presents in his book the development of the thermodynamic theory of specific intermolecular interactions for a wide spectrum of organic compounds: ethers, ketones, alcohols, carboxylic acids, and hydrocarbons. The fundamentals of an unconventional approach to the theory of H-bonding and specific interactions are formulated based on a concept of pentacoordinate carbon atoms. New types of hydrogen bonds and specific interactions are substantiated and on the basis of the developed methodology their energies are determined. The system of interconnected quantitative characteristics of the stability of specific intermolecular interactions is presented. The laws of their transformations are discussed and summarized. The new concept of the extra stabilizing effect of isomeric methyl groups on the structure and stability of organic molecules is introduced and the destabilization action on specific interactions is outlined.

We are pleased to present the ?fth volume of Progress in Ultrafast Intense LaserScience.Asthefrontiersofultrafastintenselasersciencerapidlyexpand ever outward, there continues to be a growing demand for an introduction to this interdisciplinary research ?eld that is at once widely accessible and ca- ble of delivering cutting-edge developments. Our series aims to respond to this call by providing a compilation of concise review-style articles written by researchers at the forefront of this research ?eld, so that researchers with d- ferent backgrounds as well as graduate students can easily grasp the essential aspects. As in the previous volumes of PUILS, each chapter of this book begins with an introductory part, in which a clear and concise overview of the topic and its signi?cance is given, and moves onto a description of the authors' most recent research results. All the chapters are peer-reviewed. The articles ofthis?fth volumecovera diverserangeofthe interdisciplinaryresearch?eld, and the topics may be grouped into three categories: coherent responses of gaseousand condensed matter to ultrashortintense laser pulses (Chaps. 1-4), propagationof intense laser pulses (Chaps. 5, 6), and laser-plasma interaction and its applications (Chaps. 7-10). From the third volume, the PUILS series has been edited in liaison with the activities of Center for Ultrafast Intense Laser Science in The University of Tokyo, and JILS (Japan Intense Light Field Science Society), the latter of which has also been responsible for sponsoring the series and making the regularpublicationofitsvolumespossible.Fromthe presentvolume,the C- sortiumonEducationandResearchonAdvancedLaserScience,theUniversity of Tokyo, joins this publication activity as one of the sponsoring programs.

Water in the proximity of a surface (interfacial water) is abundant on the earth. It is involved in various physical and chemical processes and crucial for biological function. Despite numerous studies of interfacial water, systematic analysis of its properties is missing in scientific literature. This book is a first comprehensive review of experimental and simulation studies of water in various confining environments, such as hydrophilic and hydrophobic surfaces, surfaces of biomolecules, porous media, etc. Systematic analysis of interfacial and confined water is based on the firm physical ground, which accounts for variety of the thermodynamic states of water near the surface, surface phase transitions, surface critical behaviour, effect of confinement on the bulk and surface phase transitions of water, clustering and formation of a spanning hydrogen-bonded water network via percolation transition. This allows distinguishing between universal features, common for all fluids, and some specific water properties, related to intermolecular hydrogen bonds. Special attention is paid to the properties of hydration water, which covers biomolecules and enables their biological activity. This book provides readers with basic information on interfacial and confined water, which will be useful for scientists and engineers working in the fields of bioscienses, nanociences and nanotechnologies.
* Comprehensive review and analysis of interfacial and confined water
* Updates and informs practitioners and students on all the latest developments in the field
* Written by leading scholars and industry experts

Supercritical fluids which are neither gas nor liquid, but can be compressed gradually from low to high density, are gaining increasing importance as tunable solvents and reaction media in the chemical process industry. By adjusting the pressure, or more strictly the density, the properties of these fluids are customized and manipulated for the particular process at hand, be it a physical transformation, such as separation or solvation, or a chemical transformation, such as a reaction or reactive extraction. Supercritical fluids, however, differ from both gases and liquids in many respects. In order to properly understand and describe their properties, it is necessary to know the implications of their nearness to criticality, to be aware of the complex types of phase separation (including solid phases) that occur when the components of the fluid mixture are very different from each other, and to develop theories that can cope with the large differences in molecular size and shape of the supercritical solvent and the solutes that are present.

Computational Modelling of Homogeneous Catalysis is an extensive collection of recent results on a wide array of catalytic processes. The chapters are, in most cases, authored by the researchers who have performed the calculations. The book illustrates the importance of computational modelling in homogeneous catalysis by providing up-to-date reviews of its application to a variety of reactions of industrial interest, including:

-olefin polymerization;
-hydrogenation;
-alkene/alkyne isomerization;
-hydroformylation;
-hydroboration; hydrosylation;
-dihydroxylation;
-benzannulation;
-epoxidation;
-N-N triple bond activation.

This book facilitates understanding by experimental chemists in the field on what has already been accomplished and what can be expected from calculations in the near future. In addition, the book provides computational chemists with a first-hand knowledge on the state of the art in this exciting field.

This book is devoted to a general discussion about localization and delocalization in quantum chemistry. The first volume is concerned with molecules in their ground state. It is made of papers presented during the academic year 73-74 at an international seminar organized by some members of the 'Centre de Mecanique Ondulatoire Appli- quee du C.N.R.S.' and some members of the 'Laboratoire de Chimie Quantique de l'Institut de Biologie Physico-Chimique'. It contains also reports of discussions which followed the presentation of invited papers. It is a 'forum' in which each expert gives his opinion on a work in progress. The volume is divided into four parts. The first one is a statistical analysis of the localizability of molecular electrons in the three-dimensional space. It contains an exposition of the basic ideas of the loge theory which provides a framework to do such an analysis. The second part is concerned with the separability of a molecular wave function and its expression in terms of localized elements. An exploration is made of the rela- tionship between the localizability of electrons and the possibility of expressing the wave function in terms of localized orbitals. The third part is devoted to the partition of the energy in local contributions.

The first model for the distribution of ions near the surface of a metal electrode was devised by Helmholtz in 1874. He envisaged two parallel sheets of charges of opposite sign located one on the metal surface and the other on the solution side, a few nanometers away, exactly as in the case of a parallel plate capacitor. The rigidity of such a model was allowed for by Gouy and Chapman inde pendently, by considering that ions in solution are subject to thermal motion so that their distribution from the metal surface turns out diffuse. Stern recognized that ions in solution do not behave as point charges as in the Gouy-Chapman treatment, and let the center of the ion charges reside at some distance from the metal surface while the distribution was still governed by the Gouy-Chapman view. Finally, in 1947, D. C. Grahame transferred the knowledge of the struc ture of electrolyte solutions into the model of a metal/solution interface, by en visaging different planes of closest approach to the electrode surface depending on whether an ion is solvated or interacts directly with the solid wall. Thus, the Gouy-Chapman-Stern-Grahame model of the so-called electrical double layer was born, a model that is still qualitatively accepted, although theoreti cians have introduced a number of new parameters of which people were not aware 50 years ago."

This book focus on COVID-19 topics, with emphasis on metabolomics and diagnosis. The chapters cover the chemical science for prevention and understanding outbreaks of infectious diseases. This book compiles the most widespread methodologies of application of quality statistical tools added to the evaluation of diagnostic tests for detection of SARS-CoV-2, metabolic behavior of COVID infection severity, and trends in rapid test for COVID-19.

Proteins are the functional units of the cellular machinery and they provide significant information regarding the molecular basis of health and disease. Therefore, techniques to separate and isolate the various proteins are critical to studying and understanding their functional characteristics. One of the widely used techniques for this purpose is electrophoresis. In Protein Electrophoresis: Methods and Protocols, contributions from experts in the field have been collected in order to provide practical guidelines to this complex study. Each chapter outlines a specific electrophoretic variant in detail so that laboratory scientists may perform a technique new to their lab without difficulty. Written in the successful Methods in Molecular Biology (TM) series format, chapters include introductions to their respective topics, lists of the necessary materials and reagents, step-by-step, readily reproducible protocols, and notes on troubleshooting and avoiding known pitfalls. Authoritative and accessible, Protein Electrophoresis: Methods and Protocols seeks to serve laboratory scientists with well-honed, detailed methodologies in an effort to further our knowledge of this essential field.

The value of the critical temperature (Tc), below which the thermal explosion of a chemical cannot occur, is indispensable to prevent such a chemical from exploding. In order to determine the Tc it has so far been necessary to measure the value in explosion experiments. Because of the inherent hazards, only few Tc values are available at present.

Critical Temperatures for the Thermal Explosion of Chemicals introduces new and simple procedures to calculate the Tc. As a result Tc can be calculated for a range of chemicals, many of which are listed in this new volume. The calculated values of Tc are shown to be in agreement with experimentally determined values.

The data and methods presented in Critical Temperatures for the Thermal Explosion of Chemicals will be of use to research laboratories as well as in the chemical industry.
* Introduces new and simple procedures for calculating critical temperatures
* Lists the T(c) values of chemicals in tables
* Explains mathematical expressions in clear simple terms

The work presented in this thesis involves a number of sophisticated experiments highlighting novel applications of the Pixel Imaging Mass Spectrometry (PImMS) camera in the field of photoinduced molecular dynamics. This approach represents the union of a new enabling technology (a multiple memory register, CMOS-based pixel detector) with several modern chemical physics approaches and represents a significant leap forward in capabilities. Applications demonstrated include three-dimensional imaging of photofragment Newton spheres, simultaneous electron-ion detection using a single sensor, and ion-ion velocity correlation measurements that open the door to novel covariance imaging experiments. When combined with Coulomb explosion imaging, such an approach is demonstrated to allow the measurement of molecular structure and motion on a femtosecond timescale. This is illustrated through the controlled photoexcitation of torsional motion in biphenyl molecules and the subsequent real-time measurement of the torsional angle.

The theme of 'escape from metastable states', either via noise-assisted hop- ping and/or quantum tunneling, is pivotal to many scientific disciplines. It impacts on suchdiversephysical,chemicalandbiologicalprocessesasdiffu- sion in solids, chemical reactions per se, nucleation phenomenaand transfer ofmatter and information in biologicalcomplexes, to name only a few. With 'New Trends in Kramers' Reaction Rate Theory' this book fills yet another part of the multifaceted scope which underpins the Understanding of Chemical Reactivity. Since the publication of the comprehensive review about reaction rate theory in Rev. Mod. Phys. 52, 251 (1990) the field has witnessed many majordevelopments and extensions both in experiment and theory. In this book the focus will be on the theoretical progress. In doing so, the editorscollected aseries ofauthoritative articles from majorpractitioners in the field which as a whole give a representative- although notcomplete- sample ofthe novel recenttheoretical advances. As an inevitable consequence, the editors recognize that not all readers will wish to digest the volume in its entirety. We trust, however, that the reader will be able to choose from the many methods and techniques which he is interested in, and which he requires to perform his own new research in this area. There is the consistent underlying theme of noise-assisted barrier crossing that is running through all of the book. Nevertheless, each chapter should be considered as self contained. In this spirit the editors share the confident beliefthat the future research on the Kramers problem, and related topics, will be invigorated by the selectedcontributions herein.

This book represents a collection of lectures presented at the NATO Advanced study Institute(ASI) on "Chemistry & Physics of the Molecular Processes in Energetic Materials," held at Hotel Torre Normanna, Altavilla Milicia, Sicily, Italy, September 3 to 15, 1989. The institute was attended by seventy participants including twenty lecturers, drawn from thirteen countries. The purpose of the institute was to review the major ad vances made in recent years in the theoretical and experi mental aspects of explosives and propellants. In accordance with the format of the NATO ASI, it was arranged to have a relatively small number of speakers to present in depth, re view type lectures emphasizing the basic research aspects of the subject, over a two week period. Most of the speakers gave two lectures, each in excess of one hour with addition al time for discussions. The scope of the meeting was limit ed to molecular and spectroscopic studies since the hydro dynamic aspects of detonation and various performance crite ria of energetic materials are often covered adequately in other international meetings. An attempt was made to have a coherent presentation of various theoretical, computational and spectroscopic approaches to help a better understanding of energetic materials from a molecular point of view. The progress already made in these areas is such that structure property (e. g."

This volume documents the scientific events of the NATO Advanced Research Workshop (ARW) on The Preparation of Nanoparticles in Solutions and in Solids. The ARW was held in the second largest city in Hungary, Szeged, truthfully referred to as "the city of sunshine," from March 8 to March 13, 1996. The seventy-seven participants, including seventeen students, came from twentyone different countries. Housing all participants together and arranging a number of social activities fostered lively discussions both inside and outside of formal sessions. Twenty-one key lectures were presented in five sessions. Each session was followed by a fortyfive minutes of general discussion. One evening was devoted to the presentation of fifty-five posters. Thirty-two contribution were submitted and accepted for publication in the present volume. The volume also contains the minutes of the discussions, and a summary of the conclusions of the working groups. The ARW was organized under the auspices and financial support of NATO, City of Szeged, European Research Office of the US Army, Hungarian Academy of Sciences, Hungarian National Committee for Technological Development (OMBF), International Association of Colloid and Interface Scientists IACIS, and National Science Foundation (NSF). Both the organizers and participants gratefully acknowledge the generous support of the agencies. The Editors also thank the high quality and creative contributions of the participants. It is they who made this volume a reality. Janos H. fendler Irnre Dekany ix Glossary of Some Names and Acronyms Advanced Materials Man-made materials having superior mechanical, thennal, electrical, optical, and other desirable properties.