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Theoretical Aspects of Chemical Reactivity provides a broad overview of recent theoretical and computational advancements in the field of chemical reactivity. Contributions have been made by a number of leaders in the field covering theoretical developments to applications in molecular systems and clusters. With an increase in the use of reactivity descriptors, and fundamental theoretical aspects becoming more challenging, this volume serves as an interesting overview where traditional concepts are revisited and explored from new viewpoints, and new varieties of reactivity descriptors a

Reactivity (Chemistry) --- Chemistry. --- Physical sciences --- Chemical reaction, Conditions and laws of --- Chemical reactions

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This book offers a look into the field of Quantum Mechanics with respect to orbital perturbations at the atomic level. It takes the approach of studying perturbations in a more simplified fashion. "Orbital Frontiers" deals with the common problems associated with the nature of atomic uncertainties and reactions. It is presented in a simple and readable format. This book is intended for non-theoreticians and graduate students.

Molecular orbitals. --- Reactivity (Chemistry) --- Perturbation (Quantum dynamics) --- Chemical reaction, Conditions and laws of --- Chemical reactions --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Quantum chemistry --- Valence (Theoretical chemistry) --- Wave mechanics --- Perturbation theory, Quantum mechanical --- Perturbation (Mathematics) --- Quantum theory

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This third edition retains the general level and scope of earlier editions, but has been substantially updated with over 900 new references covering the literature through 2005, and 140 more pages of text than the previous edition. In addition to the general updating of materials, there is new or greatly expanded coverage of topics such as Curtin-Hammett conditions, pressure effects, metal hydrides and asymmetric hydrogenation catalysts, the inverted electron-transfer region, intervalence electron transfer, photochemistry of metal carbonyls, methyl transferase and nitric oxide synthase. The new chapter on heterogeneous systems introduces the basic background to this industrially important area. The emphasis is on inorganic examples of gas/liquid and gas/liquid/solid systems and methods of determining heterogeneity.

Reaction mechanisms (Chemistry) --- Organometallic compounds. --- Inorganic compounds. --- Compounds, Inorganic --- Inorganic chemicals --- Chemicals --- Chemistry, Inorganic --- Metallo-organic compounds --- Metalloids, Organic --- Metalorganic compounds --- Organometalloids --- Organic compounds --- Inorganic reaction mechanisms --- Mechanisms, Inorganic reaction --- Mechanisms, Reaction (Chemistry) --- Reaction mechanisms, Inorganic --- Chemical reaction, Conditions and laws of

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Organized to facilitate reference to the reagents involved, this book describes the reactions of the elements and their mostly simpler compounds, primarily inorganic ones and primarily in water. It emphasizes the similarities and differences in actual chemical behavior, as opposed to electronic structures and theories, although not exclusively. Inorganic Reactions in Water again makes available some of the more comprehensive coverage of descriptive aqueous chemistry found in older sources, but now corrected and interpreted with the added insights of the last seven decades. It also provides new information, including reactions of the recently discovered elements, plus some recent data on equilibria, often with mostly qualitative kinetic information, to interpret the redox and non-redox phenomena that complicate the chemistry of most elements in water.

Reaction mechanisms (Chemistry) --- Water. --- Chemical tests and reagents. --- Chemistry, Inorganic. --- Inorganic chemistry --- Chemistry --- Inorganic compounds --- Chemical reagents --- Reagents, Chemical --- Indicators and test-papers --- Hydrology --- Inorganic reaction mechanisms --- Mechanisms, Inorganic reaction --- Mechanisms, Reaction (Chemistry) --- Reaction mechanisms, Inorganic --- Chemical reaction, Conditions and laws of --- Chemistry, inorganic. --- Analytical biochemistry. --- Chemistry, Organic. --- Chemistry, Physical organic. --- Biochemistry. --- Inorganic Chemistry. --- Analytical Chemistry. --- Organic Chemistry. --- Physical Chemistry. --- Biochemistry, general. --- Biological chemistry --- Chemical composition of organisms --- Organisms --- Physiological chemistry --- Biology --- Medical sciences --- Chemistry, Physical organic --- Chemistry, Organic --- Chemistry, Physical and theoretical --- Organic chemistry --- Analytic biochemistry --- Biochemistry --- Chemistry, Analytic --- Composition --- Bioanalytic chemistry --- Bioanalytical chemistry --- Analytical chemistry --- Inorganic chemistry. --- Analytical chemistry. --- Organic chemistry. --- Physical chemistry. --- Chemistry, Theoretical --- Physical chemistry --- Theoretical chemistry --- Analysis, Chemical --- Analytic chemistry --- Chemical analysis