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Books > Science & Mathematics > Chemistry > Physical chemistry > General

Untangling Complex Systems - A Grand Challenge for Science (Hardcover): Pier Luigi Gentili Untangling Complex Systems - A Grand Challenge for Science (Hardcover)
Pier Luigi Gentili
R5,034 Discovery Miles 50 340 Ships in 12 - 17 working days

Complex Systems are natural systems that science is unable to describe exhaustively. Examples of Complex Systems are both unicellular and multicellular living beings; human brains; human immune systems; ecosystems; human societies; the global economy; the climate and geology of our planet. This book is an account of a marvelous interdisciplinary journey the author made to understand properties of the Complex Systems. He has undertaken his trip, equipped with the fundamental principles of physical chemistry, in particular, the Second Law of Thermodynamics that describes the spontaneous evolution of our universe, and the tools of Non-linear dynamics. By dealing with many disciplines, in particular, chemistry, biology, physics, economy, and philosophy, the author demonstrates that Complex Systems are intertwined networks, working in out-of-equilibrium conditions, which exhibit emergent properties, such as self-organization phenomena and chaotic behaviors in time and space.

Applications of Hydrogen Peroxide and Derivatives (Hardcover): C.W. Jones Applications of Hydrogen Peroxide and Derivatives (Hardcover)
C.W. Jones; Series edited by James H. Clark, M.J. Braithwaite
R2,992 Discovery Miles 29 920 Ships in 12 - 17 working days

Simple, but beautifully versatile. Perhaps not a description many would choose for hydrogen peroxide, but an accurate one none the less, and this unique book explains the reasons behind the description. Beginning with an historical overview, and guidelines for the safe handling of peroxygens, Applications of Hydrogen Peroxide and Derivatives goes on to cover key activation mechanisms, organic functional group oxidations and the use of hydrogen peroxide with heterogeneous catalysts. The clean-up of environmental pollutants; chemical purification; and extraction of metals from their ores are also discussed in detail, using actual examples from industry. The versatility of this reagent may well prove to be a key to integrated pollution control in the future. This book should therefore be read by academics and industrialists at all levels, to encourage wider applications of the use of hydrogen peroxide in laboratories.

Conceptual Density Functional Theory and Its Application in the Chemical Domain (Hardcover): Nazmul Islam, Savas Kaya Conceptual Density Functional Theory and Its Application in the Chemical Domain (Hardcover)
Nazmul Islam, Savas Kaya
R3,606 Discovery Miles 36 060 Ships in 12 - 17 working days

In this book, new developments based on conceptual density functional theory (CDFT) and its applications in chemistry are discussed. It also includes discussion of some applications in corrosion and conductivity and synthesis studies based on CDFT. The electronic structure principles-such as the electronegativity equalization principle, the hardness equalization principle, the electrophilicity equalization principle, and the nucleophilicity equalization principle, along studies based on these electronic structure principles-are broadly explained. In recent years some novel methodologies have been developed in the field of CDFT. These methodologies have been used to explore mutual relationships between the descriptors of CDFT, namely electronegativity, hardness, etc. The mutual relationship between the electronegativity and the hardness depend on the electronic configuration of the neutral atomic species. The volume attempts to cover almost all such methodology. Conceptual Density Function Theory and Its Application in the Chemical Domain will be an appropriate guide for research students as well as the supervisors in PhD programs. It will also be valuable resource for inorganic chemists, physical chemists, and quantum chemists. The reviews, research articles, short communications, etc., covered by this book will be appreciated by theoreticians as well as experimentalists.

Exam Survival Guide: Physical Chemistry (Hardcover, 1st ed. 2017): Jochen Vogt Exam Survival Guide: Physical Chemistry (Hardcover, 1st ed. 2017)
Jochen Vogt
R2,846 Discovery Miles 28 460 Ships in 12 - 17 working days

A text- and exercise book for physical chemistry students! This book deals with the fundamental aspects of physical chemistry taught at the undergraduate level in chemistry and the engineering sciences in a compact and practice-oriented form. Numerous problems and detailed solutions offer the possibility of an in-depth reflection of topics like chemical thermodynamics and kinetics, atomic structure and spectroscopy. Every chapter starts with a recapitulation of important background information, before leading over to representative exercises and problems. Detailed descriptions systematically present and explain the solutions to the problems, so that readers can carefully check their own solutions and get clear-cut introductions on how to approach similar problems systematically. The book addresses students at the (upper) undergraduate level, as well as tutors and teachers. It is a rich source of exercises for exam preparation and can be used alongside classical textbooks. Furthermore it can serve teachers and tutors for the conception of their lessons. Its well-thought-through presentation, structure and design make the book appeal to everybody who wants to succeed with the physical chemistry lessons and exercises.

Unimolecular and Supramolecular Electronics I - Chemistry and Physics Meet at Metal-Molecule Interfaces (Hardcover, 2012 ed.):... Unimolecular and Supramolecular Electronics I - Chemistry and Physics Meet at Metal-Molecule Interfaces (Hardcover, 2012 ed.)
Robert M. Metzger
R8,105 Discovery Miles 81 050 Ships in 10 - 15 working days

Charge Transport in Organic Semiconductors, by Heinz Bassler and Anna Kohler. Frontiers of Organic Conductors and Superconductors, by Gunzi Saito and Yukihiro Yoshida. Fullerenes, Carbon Nanotubes, and Graphene for Molecular Electronics, by Julio R. Pinzon, Adrian Villalta-Cerdas and Luis Echegoyen. Current Challenges in Organic Photovoltaic Solar Energy Conversion, by Cody W. Schlenker and Mark E. Thompson.- Molecular Monolayers as Semiconducting Channels in Field Effect Transistors, by Cherie R. Kagan. Issues and Challenges in Vapor-Deposited Top Metal Contacts for Molecule-Based Electronic Devices, by Masato M. Maitani and David L. Allara. Spin Polarized Electron Tunneling and Magnetoresistance in Molecular Junctions, by Greg Szulczewski."

Tensor Properties of Crystals (Hardcover, 2nd edition): D. Lovett Tensor Properties of Crystals (Hardcover, 2nd edition)
D. Lovett
R5,981 Discovery Miles 59 810 Ships in 12 - 17 working days

The use of single crystals for scientific and technological applications is now widespread in solid-state physics, optics, electronics, materials science, and geophysics. An understanding of the variation of physical properties with crystalline direction is essential to maximize the performance of solid-state devices. Written from a physical viewpoint and avoiding advanced mathematics, Tensor Properties of Crystals provides a concise introduction to the tensor properties of crystals at a level suitable for advanced undergraduate and graduate students. While retaining the successful basic format of the well-known first edition, this second edition brings the material up to date with the latest developments in nonlinear optics and modulated structures. Because of the increasing importance of nonlinear optics, a new chapter on optoelectronics has been added. This edition also includes a short discussion on incommensurate modulated structures in the final chapter because they are relevant to high temperature superconductors and to ferroelectric and ferromagnetic materials. The book extensively contains diagrams, worked examples, and problems with answers throughout.

Modern Optics and Photonics of Nano-  and Microsystems (Hardcover): Yu. N. Kulchin Modern Optics and Photonics of Nano- and Microsystems (Hardcover)
Yu. N. Kulchin
R6,118 Discovery Miles 61 180 Ships in 12 - 17 working days

This book cover advances in the study of processes of nonlinear propagation of continuous and pulsed laser radiation in a continuous and micro structured optical media. It details distributed fiber-optical measuring systems, the physical basis of ultra-low laser cooling of atoms, and studies of optical and nonlinear optical properties of nanostructured heterogeneous systems.

Gases In Medicine - Anaesthesia (Hardcover): Colin A. Russell, N.G. Coley, V. Campbell, R.M. Jones, S. Moncada, M.J. Halsey, C.... Gases In Medicine - Anaesthesia (Hardcover)
Colin A. Russell, N.G. Coley, V. Campbell, R.M. Jones, S. Moncada, …
R2,329 Discovery Miles 23 290 Ships in 12 - 17 working days

There have been many developments in anaesthesia since Joseph Priestley discovered nitrous oxide. Covering new anaesthetics, the molecular and cellular mechanisms of anaesthesia and the non-hypnotic effects of anaesthetics and other medical gases, Gases in Medicine combines reviews of current research from both academic and clinical perspectives and provides an historical framework in which this research may be placed. Encompassing a wide range of topics including intravenous anaesthetics, neural processes and the 1997 Priestley Lecture on nitric oxide, this book offers an accessible summary of anaesthesia along with the current best research. Also included is the BOC Centenary Lecture, which gives a perspective on anaesthesia for the 21st century. This book will be welcomed by readers in academia and medicine as an illustration of the diversity of research into anaesthesia and the associated history of this fascinating subject.

Principles of Coordination Polymerisation (Hardcover): W. Kuran Principles of Coordination Polymerisation (Hardcover)
W. Kuran
R11,164 Discovery Miles 111 640 Ships in 12 - 17 working days

Principles of Coordination Polymerisation, is one of the first books to offer a unified and almost complete view of coordination polymerisation. It focuses on the polymerisation of monomers, belonging to all the important classes of hydrocarbons and non-hydrocarbon monomers, in the presence of various kinds of coordination catalysts.

Taking a user-friendly approach the book examines how the catalyst is involved in each step of the monomer coordination polymerisation process and presents:

  • the basic mechanisms which occur during the coordination polymerisation process
  • coordination polymerisation of unsaturated hydrocarbon monomers, such as olefins
  • problems connected with coordination polymerisation of non-hydrocarbon monomers, such as heterocyclic and heterounsaturated monomers
  • the role of co-polymerisation in the plastics and rubber industries
  • useful problem exercises at the end of each chapter

Written by a polymer and organometallic scientist with over 30 years experience of monomer polymerisation, this book will be essential reading for graduate researchers studying polymer science and all research scientists in the plastics and rubber industries.

Drugs - Photochemistry and Photostability (Hardcover): Angelo Albini, E. Fasani Drugs - Photochemistry and Photostability (Hardcover)
Angelo Albini, E. Fasani
R2,679 Discovery Miles 26 790 Ships in 12 - 17 working days

Since Pasteur in 1846, scientists have been aware that many drugs are photoreactive, but until recently research in this area had been somewhat limited. However, since the introduction of acutely sensitive analytical methods, the realisation of the need to identify the photochemical properties of a potential drug as early in its development as possible and the increased attention to the phototoxic effect of drugs, more details are becoming available. Drugs: Photochemistry and Photostability presents the basic elements of the science, and serves as an excellent introduction to this emerging field of photochemistry. Detailed experimental conditions for photostability studies are given, along with a discussion of the recently implemented ICH Guidelines for drug photostability. With contributions from international experts in the field and including a comprehensive literature review, this book provides all the up-to-date information needed by researchers in many fields, especially medicinal and pharmaceutical chemistry.

Electrical Phenomena at Interfaces - Fundamentals: Measurements, and Applications (Hardcover, 2nd edition): Hiroyuki Ohshima Electrical Phenomena at Interfaces - Fundamentals: Measurements, and Applications (Hardcover, 2nd edition)
Hiroyuki Ohshima
R10,669 Discovery Miles 106 690 Ships in 12 - 17 working days

Revising, updating and expanding information on developments since the late 1980s, the second edition of this work presents practical, fundamental material on interfacial electric phenomena in acqueous and nonaqueous systems, as well as their relation to colloid stability. The book includes 15 additional chapters that reflect collaborative efforts with new experts in the field.

Chemical Dissolution of Metal Oxides (Hardcover): Miguel A Blesa Chemical Dissolution of Metal Oxides (Hardcover)
Miguel A Blesa
R6,857 Discovery Miles 68 570 Ships in 12 - 17 working days

The dissolution behaviour of metal oxides has applications in many scientific fields, each with its own jargon and methodological approach. Any scientist interested in this subject should understand the literature from these various areas. This book describe different specialized treatments to surface-controlled metal oxide dissolution reactions and translates them into a unified picture based on surface complexion

Chemical Dynamics in Condensed Phases - Relaxation, Transfer and Reactions in Condensed Molecular Systems (Hardcover): Abraham... Chemical Dynamics in Condensed Phases - Relaxation, Transfer and Reactions in Condensed Molecular Systems (Hardcover)
Abraham Nitzan
R4,755 Discovery Miles 47 550 Ships in 12 - 17 working days

This text provides a uniform and consistent approach to diversified problems encountered in the study of dynamical processes in condensed phase molecular systems. Given the broad interdisciplinary aspect of this subject, the book focuses on three themes: coverage of needed background material, in-depth introduction of methodologies, and analysis of several key applications. The uniform approach and common language used in all discussions help to develop general understanding and insight on condensed phases chemical dynamics. The applications discussed are among the most fundamental processes that underlie physical, chemical and biological phenomena in complex systems.
The first part of the book starts with a general review of basic mathematical and physical methods (Chapter 1) and a few introductory chapters on quantum dynamics (Chapter 2), interaction of radiation and matter (Chapter 3) and basic properties of solids (chapter 4) and liquids (Chapter 5). In the second part the text embarks on a broad coverage of the main methodological approaches. The central role of classical and quantum time correlation functions is emphasized in Chapter 6. The presentation of dynamical phenomena in complex systems as stochastic processes is discussed in Chapters 7 and 8. The basic theory of quantum relaxation phenomena is developed in Chapter 9, and carried on in Chapter 10 which introduces the density operator, its quantum evolution in Liouville space, and the concept of reduced equation of motions. The methodological part concludes with a discussion of linear response theory in Chapter 11, and of the spin-boson model in chapter 12. The third part of the book applies the methodologies introducedearlier to several fundamental processes that underlie much of the dynamical behaviour of condensed phase molecular systems. Vibrational relaxation and vibrational energy transfer (Chapter 13), Barrier crossing and diffusion controlled reactions (Chapter 14), solvation dynamics (Chapter 15), electron transfer in bulk solvents (Chapter 16) and at electrodes/electrolyte and metal/molecule/metal junctions (Chapter 17), and several processes pertaining to molecular spectroscopy in condensed phases (Chapter 18) are the main subjects discussed in this part.

Friction-Induced Vibrations and Self-Organization - Mechanics and Non-Equilibrium Thermodynamics of Sliding Contact... Friction-Induced Vibrations and Self-Organization - Mechanics and Non-Equilibrium Thermodynamics of Sliding Contact (Paperback)
Michael Nosonovsky, Vahid Mortazavi
R2,686 Discovery Miles 26 860 Ships in 12 - 17 working days

Many scientists and engineers do not realize that, under certain conditions, friction can lead to the formation of new structures at the interface, including in situ tribofilms and various patterns. In turn, these structures-usually formed by destabilization of the stationary sliding regime-can lead to the reduction of friction and wear. Friction-Induced Vibrations and Self-Organization: Mechanics and Non-Equilibrium Thermodynamics of Sliding Contact combines the mechanical and thermodynamic methods in tribology, thus extending the field of mechanical friction-induced vibrations to non-mechanical instabilities and self-organization processes at the frictional interface. The book also relates friction-induced self-organization to novel biomimetic materials, such as self-lubricating, self-cleaning, and self-healing materials. Explore Friction from a Different Angle-as a Fundamental Force of Nature The book begins with an exploration of friction as a fundamental force of nature throughout the history of science. It then introduces general concepts related to vibrations, instabilities, and self-organization in the bulk of materials and at the interface. After presenting the principles of non-equilibrium thermodynamics as they apply to the interface, the book formulates the laws of friction and highlights important implications. The authors also analyze wear and lubrication. They then turn their attention to various types of friction-induced vibration, and practical situations and applications where these vibrations are important. The final chapters consider various types of friction-induced self-organization and how these effects can be used for novel self-lubricating, self-cleaning, and self-healing materials. From Frictional Instabilities to Friction-Induced Self-Organization Drawing on the authors' original research, this book presents a new, twenty-first century perspective on friction and tribology. It shows how friction-induced instabilities and vibrations can lead to self-organized structures, and how understanding the structure-property relationships that lead to self-organization is key to designing "smart" biomimetic materials.

Nonionic Surfactants - Organic Chemistry (Hardcover): Nico m Van Os Nonionic Surfactants - Organic Chemistry (Hardcover)
Nico m Van Os
R7,949 Discovery Miles 79 490 Ships in 12 - 17 working days

Discusses the laboratory and industrial synthesis of nonionic surfactants. Furnishes exhaustive coverage of the most recent advances in nonionic surfactant organic chemistry. Analyzes a novel class of catalysts for the production of surfactants with highly narrow distributions.

A Working Method Approach for Introductory Physical Chemistry Calculations (Paperback): Brian J. Hathaway, Clair Murphy, Brian... A Working Method Approach for Introductory Physical Chemistry Calculations (Paperback)
Brian J. Hathaway, Clair Murphy, Brian Murphy
R886 Discovery Miles 8 860 Ships in 12 - 17 working days

A Working Method Approach for Introductory Physical Chemistry Calculations is a concise inexpensive introduction to first year chemistry that is aimed at students who are weak in chemistry or have no chemistry on entry to university. Such students usually find physical chemistry the most difficult part of the chemistry course, and within this section numerical problem solving is an additional difficulty. The text should also be invaluable to first year intending chemists. This text provides an introduction to physical chemistry and the gas laws, followed by chapters on thermodynamics, chemical equilibrium, electrochemistry and chemical kinetics. Each section involves a brief introduction followed by a representative examination question, which is broken down into a proposed working method. Both short multiple-choice questions and related full examination-type questions are included. This book will prove invaluable to students who need encouragement in a logical approach to problem solving in physical chemistry, teaching them to think for themselves when faced with a problem.

Physics and Chemistry of Photochromic Glasses (Hardcover): Alexander V. Dotsenko, Leonid B. Glebov, Victor A. Tsechomsky Physics and Chemistry of Photochromic Glasses (Hardcover)
Alexander V. Dotsenko, Leonid B. Glebov, Victor A. Tsechomsky
R5,109 R4,159 Discovery Miles 41 590 Save R950 (19%) Ships in 12 - 17 working days

Photochromic glasses are among the most widespread types of glasses, due largely to their popular use in sunglasses. These glasses are used not only in sunglasses, but also in various opto-electronic devices that have been developed and produced throughout the world. Until now, information about photochromic glasses has been widely dispersed in the literature, much of which was published in Russian and therefore of limited accessibility to the Western world. Physics and Chemistry of Photochromic Glasses brings together the combined knowledge and understanding of photochromic glasses from these publications. Coverage includes the structure, optical properties, coloration and bleaching mechanisms, technology, and metrology of these interesting materials.

Kinetic Theory of Granular Gases (Hardcover, New): Nikolai V. Brilliantov, Thorsten Poeschel Kinetic Theory of Granular Gases (Hardcover, New)
Nikolai V. Brilliantov, Thorsten Poeschel
R3,809 R2,853 Discovery Miles 28 530 Save R956 (25%) Ships in 12 - 17 working days

Kinetic Theory of granular Gases provides an introduction to the rapidly developing theory of dissipative gas dynamics as it has been developed mainly during the past decade. The book is aimed at readers from the advanced undergraduate level onwards and leads up to the present state of research. The text is self-contained, in the sense that no mathematical or physical knowledge is required that goes beyond standard undergraduate physics courses. The material is adequate for a one-semester course and contains chapter summaries as well as exercises with detailed solutions. Special emphasis is put on a microscopically consistent description of pairwise particle collisions which leads to an impact-velocity dependent coefficient of restitution. The description of the many-particle system, based on the Boltzmann equation, starts with the derivation of the velocity distribution function, followed by the investigation of self-diffusion and Brownian motion. Using hydrodynamical methods, transport processes and self-organized structure formulation are studies. An appendix gives a brief introduction to event-driven molecular dynamics. A second appendix describes a novel mathematical technique for the derivation of the kinetic properties which allows for the application of computer algebra. The book is accompanied by a web page where the molecular dynamics program as well as the computer-algebra programs are provided.

Surfactants in Cosmetics (Hardcover, 2nd edition): Martin Rieger Surfactants in Cosmetics (Hardcover, 2nd edition)
Martin Rieger
R10,671 Discovery Miles 106 710 Ships in 12 - 17 working days

"Second Edition provides a thorough, up-to-date treatment of the fundamental behavior of surface active agents in solutions, their interaction with biological structures from proteins and membranes to the stratum corneum and epidermis, and their performance in formulations such as shampoos, dentifrice, aerosols, and skin cleansers."

Manual of Physico-Chemical Analysis of Aquatic Sediments (Hardcover): Alena Mudroch Manual of Physico-Chemical Analysis of Aquatic Sediments (Hardcover)
Alena Mudroch
R5,290 Discovery Miles 52 900 Ships in 12 - 17 working days

Because water is one of the most important life-supporting media on the planet, the quality of aquatic ecosystems is of great interest to the entire world population. One of the factors that greatly affects water quality is the condition of the underlying sediment layer. The Manual of Physico-Chemical Analysis of Aquatic Sediments addresses the best methods for quantitative determination of chemical forms of different elements and compounds, bioassessment techniques, and determination of physical properties of sediments. Essential information for surveying, research, and monitoring of sediment contamination is covered. This manual will aid sediment biologists, geochemists, limnologists, regulatory program managers, environmental chemists and toxicologists and environmental consultants in preparing plans for proper remedial action.

Handbook of Antioxidants - Bond Dissociation Energies, Rate Constants, Activation Energies, and Enthalpies of Reactions... Handbook of Antioxidants - Bond Dissociation Energies, Rate Constants, Activation Energies, and Enthalpies of Reactions (Hardcover)
Evguenii T. Denisov
R2,673 Discovery Miles 26 730 Ships in 12 - 17 working days

Designed for scientists and engineers involved in the physical chemistry of antioxidants, the Handbook of Antioxidants contains comprehensive data on the thermodynamics and reactivity of antioxidants. It includes: bond dissociation energies of antioxidants such as phenols (O-H bonds), aromatic amines (N-H bonds), hydroxyl amines (O-H bonds), thiophenols (S-H bonds) o activation energies and rate constants of reactions of peroxyl radicals with antioxidants o rate constants of reactions of phenoxyl, aminyl, and nitroxyl radicals with RH, ROOH, phenols, thiophenols, amines and hydroxyl amines and rate constants of reactions of antioxidants with hydroperoxides and oxygen.

Nanoscience - Colloidal and Interfacial Aspects (Paperback): Victor M. Starov Nanoscience - Colloidal and Interfacial Aspects (Paperback)
Victor M. Starov
R3,410 Discovery Miles 34 100 Ships in 12 - 17 working days

The common perception is that nanoscience is something entirely new, that it sprung forth whole and fully formed like some mythological deity. But the truth is that like all things scientific, nanoscience is the natural result of the long evolution of scientific inquiry. Following a historical trail back to the middle of the 19th century, nanoscience is the inborn property of colloid and interface science. What's important today is for us to recognize that nanoparticles are small colloidal objects. It should also be appreciated that over the past decades, a number of novel nanostructures have been developed, but whatever we call them, we cannot forget that their properties and behavior are still in the realm of colloid and interface science. However one views it, the interest and funding in nano-science is a tremendous opportunity to advance critical research in colloid chemistry. Nanoscience: Colloidal and Interfacial Aspects brings together a prominent roster of 42 leading investigators and their teams, who detail the wide range of theoretical and experimental knowledge that can be successfully applied for investigating nanosystems, many of which are actually well-known colloidal systems. This international grouping of pioneering investigators from academia and industry use these pages to provide researchers of today and tomorrow with a full examination of nano-disperse colloids, homogeneous and heterogeneous nano-structured materials (and their properties), and shelf-organization at the nano-scale. This cutting-edge reference provides information on investigations into non-linear electrokinetic phenomena in nano-sized dispersions and nano-sized biological systems. It discusses application aspects of technological processes in great detail, providing scientists and engineers across all fields with authoritative commentary on colloid and interface science operating at the nanoscale. Nano-Science: Colloidal and Interfacial Aspects provides an authoritative resource for those wanting to familiarize themselves with current progress as well as for those looking to make their own impact on the development of new technologies and practical applications in fields as diverse as medicine, materials, and environmental science to name but a few. Whether you call the technology nano or colloids, the field continues to be ripe with opportunity.

The Symmetric Group in Quantum Chemistry (Hardcover): R. Pauncz The Symmetric Group in Quantum Chemistry (Hardcover)
R. Pauncz
R6,144 Discovery Miles 61 440 Ships in 12 - 17 working days

This is the first book to provide comprehensive treatment of the use of the symmetric group in quantum chemical structures of atoms, molecules, and solids. It begins with the conventional Slater determinant approach and proceeds to the basics of the symmetric group and the construction of spin eigenfunctions. The heart of the book is in the chapter dealing with spin-free quantum chemistry showing the great interpretation value of this method. The last three chapters include the unitary group approach, the symmetric group approach, and the spin-coupled valence bond method. An extensive bibliography concludes the book.

Chemical Reaction Networks - A Graph-Theoretical Approach (Hardcover, New): Oleg N. Temkin, Andrew V. Zeigarnik, D. G. Bonchev Chemical Reaction Networks - A Graph-Theoretical Approach (Hardcover, New)
Oleg N. Temkin, Andrew V. Zeigarnik, D. G. Bonchev
R6,139 Discovery Miles 61 390 Ships in 12 - 17 working days

Over the last decade, increased attention to reaction dynamics, combined with the intensive application of computers in chemical studies, mathematical modeling of chemical processes, and mechanistic studies has brought graph theory to the forefront of research. It offers an advanced and powerful formalism for the description of chemical reactions and their intrinsic reaction mechanisms. Chemical Reaction Networks: A Graph-Theoretical Approach elegantly reviews and expands upon graph theory as applied to mechanistic theory, chemical kinetics, and catalysis. The authors explore various graph-theoretical approaches to canonical representation, numbering, and coding of elementary steps and chemical reaction mechanisms, the analysis of their topological structure, the complexity estimation, and classification of reaction mechanisms. They discuss topologically distinctive features of multiroute catalytic and noncatalytic and chain reactions involving metal complexes. With it's careful balance of clear language and mathematical rigor, the presentation of the authors' significant original work, and emphasis on practical applications and examples, Chemical Reaction Networks: A Graph Theoretical Approach is both an outstanding reference and valuable tool for chemical research.

Graph-Theoretical Matrices in Chemistry (Paperback): Dusanka Janezic, Ante Milicevic, Sonja Nikolic, Nenad Trinajstic Graph-Theoretical Matrices in Chemistry (Paperback)
Dusanka Janezic, Ante Milicevic, Sonja Nikolic, Nenad Trinajstic
R1,832 Discovery Miles 18 320 Ships in 12 - 17 working days

Graph-Theoretical Matrices in Chemistry presents a systematic survey of graph-theoretical matrices and highlights their potential uses. This comprehensive volume is an updated, extended version of a former bestseller featuring a series of mathematical chemistry monographs. In this edition, nearly 200 graph-theoretical matrices are included. This second edition is organized like the previous one-after an introduction, graph-theoretical matrices are presented in five chapters: The Adjacency Matrix and Related Matrices, Incidence Matrices, The Distance Matrix and Related Matrices, Special Matrices, and Graphical Matrices. Each of these chapters is followed by a list of references. Among the matrices presented several are novel and some are known only to a few. The properties and potential usefulness of many of the presented graph-theoretical matrices in chemistry have yet to be investigated. Most of the graph-theoretical matrices presented have been used as sources of molecular descriptors usually referred to as topological indices. They are particularly concerned with a special class of graphs that represents chemical structures involving molecules. Due to its multidisciplinary scope, this book will appeal to a broad audience ranging from chemistry and mathematics to pharmacology.

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