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Chemical Modelling
Chemical Modelling: Applications and Theory comprises critical literature reviews of molecular modelling, both theoretical and applied. Molecular modelling in this context refers to modelling the structure, properties and reactions of atoms, molecules & materials. Each chapter is compiled by experts in their fields and provides a selective review of recent literature, incorporating sufficient historical perspective for the non-specialist to gain an understanding. With chemical modelling covering such a wide range of subjects, this Specialist Periodical Report serves as the first port of call to any chemist, biochemist, materials scientist or molecular physicist needing to acquaint themselves with major developments in the area.
Introduction
Nuclear chemistry represents a vital field of basic and applied research. This Introduction to Nuclear Chemistry describes the relevant parameters of instable atomic nuclei, the various modi of radioactive transmutations, the corresponding types of radiation including their detection and dosimetry, and finally the mechanisms of nuclear reactions. This new edition has updated lirature references and new material throughout.
Chemical Laboratory
This book covers techniques in the chemical laboratory and safety procedures that are crucial to making the laboratory a safe workplace. The book is divided into two sections, the 1st comprehensively covering safety protocols in a chemical laboratory and the 2nd detailing important techniques to master. This book can be utilized by graduate students, laboratory technicians, and laboratory chemists.
Quantum Chemistry
This textbook introduces the reader to quantum theory and quantum chemistry. The textbook is meant for 2nd – 3rd year bachelor students of chemistry or physics, but also for students of related disciplines like materials science, pharmacy, and bioinformatics. At first, quantum theory is introduced, starting with experimental results that made it inevitable to go beyond classical physics. Subsequently, the Schrödinger equation is discussed in some detail. Some few examples for which the Schrödinger equation can be solved exactly are treated with special emphasis on relating the results to real systems and interpreting the mathematical results in terms of experimental observations. Ultimat...
Recent Progress in Computational Sciences and Engineering (2 vols)
This volume brings together selected contributed papers presented at the International Conference of Computational Methods in Science and Engineering (ICCMSE 2006), held in Chania, Greece, October 2006. The conference aims to bring together computational scientists from several disciplines in order to share methods and ideas. The ICCMSE is unique in its kind. It regroups original contributions from all fields of the traditional Sciences, Mathematics, Physics, Chemistry, Biology, Medicine and all branches of Engineering. It would be perhaps more appropriate to define the ICCMSE as a conference on computational science and its applications to science and engineering. Topics of general interest...
Handbook of Computational Chemistry
The role the Handbook of Computational Chemistry is threefold. It is primarily intended to be used as a guide that navigates the user through the plethora of computational methods currently in use; it explains their limitations and advantages; and it provides various examples of their important and varied applications. This reference work is presented in three volumes. Volume I introduces the different methods used in computational chemistry. Basic assumptions common to the majority of computational methods based on molecular, quantum, or statistical mechanics are outlined and special attention is paid to the limits of their applicability. Volume II portrays the applications of computational...
Chemical Technicians
This book for chemical technicians contains a variety of skills that chemical technicians and technicians who work in chemical plants should develop as part of their successful experience. Many of these competencies were unintentionally addressed in other resources in a dispersed way across chapters in various textbooks and internet resources, but many others were not. The book also provides a brief overview of the tasks that various chemical laboratory technicians must perform as part of their employment. It also includes a thorough explanation of the sampling techniques, chemical analysis, and a description of the various tools and methods used in chemical labs. Additionally the book covers information management systems and good practices in laboratories, as well as how these have allowed and facilitated best practices in laboratories and the gathering of data that improves technicians’ experience and knowledge. Finally, some advice on using lab glassware, laboratory emergency first aid, and a short description of the chemicals that chemical technicians frequently use are provided.
Who's Who in Plastics Polymers, First Edition
This is the first edition of a unique new plastics industry resource: Who's Who in Plastics & Polymers. It is the only biographical directory of its kind and includes contact, affiliation and background information on more than 3300 individuals who are active leaders in this industry and related organizations. The biographical directory is in alphabetical order by individual name. After each individual name, current affiliation and contact information is provided. This includes job title, full name of affiliation (e.g., business, university, association, research institute), business address, and electronic contacts-telephone, fax, e-mail and Web site. Home addresses and contacts are also pr...
Aromaticity and Metal Clusters
Metal clusters, an intermediate state between molecules and the extended solid, show peculiar bonding and reactivity patterns. Their significance is critical to many areas, including air pollution, interstellar matter, clay minerals, photography, catalysis, quantum dots, and virus crystals. In Aromaticity and Metal Clusters, dozens of international experts explore not only the basic aspects of aromaticity, but also the structures, properties, reactivity, stability, and other consequences of the aromaticity of a variety of metal clusters. Although the concept of aromaticity has been known for nearly two centuries, there is no way to measure it experimentally and no theoretical formula to calc...
Chemical Modelling
Chemical modelling covers a wide range of disciplines, and this book is the first stop for any chemist, materials scientist, biochemist, or molecular physicist wishing to acquaint themselves with major developments in the applications and theory of chemical modelling. Containing both comprehensive and critical reviews, it is a convenient reference to the current literature. Coverage includes, but is not limited to, considerations towards rigorous foundations for the natural-orbital representation of molecular electronic transitions, quantum and classical embedding schemes for optical properties, machine learning for excited states, ultrafast and wave function-based electron dynamics, and attosecond chemistry.
