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Quantum chemistry --- fysicochemie --- Molecular orbitals --- Orbites moléculaires --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Valence (Theoretical chemistry) --- Wave mechanics --- Molecular orbitals. --- Orbites moléculaires
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Organic materials with extraordinary magnetic properties promise a wide range of light, flexible, and inexpensive alternatives to familiar metal-based magnets. Individual organic molecules with high magnetic moments will be the foundation for design and fabrication of these materials. This book provides a systematic understanding of the structure and properties of organic magnetic molecules. After a summary of the phenomenon of magnetism at the molecular level, it presents a survey of the challenges to theoretical description and evaluation of the magnetic character of open-shell molecules, an
Magnetochemistry. --- Molecular orbitals. --- Molecules --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Overlap integral --- Quantum chemistry --- Valence (Theoretical chemistry) --- Wave mechanics --- Electrochemistry --- Magnetism --- Magnetic properties.
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Quantum chemistry --- fysicochemie --- Molecular orbitals --- 530.1 --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Valence (Theoretical chemistry) --- Wave mechanics --- Basic principles of physics --- Molecular orbitals. --- 530.1 Basic principles of physics
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Quantum chemistry --- fysicochemie --- Molecular physics --- 541 --- 530.145 --- Molecular orbitals --- #WSCH:AAS2 --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Valence (Theoretical chemistry) --- Wave mechanics --- Theoretical chemistry --- Quantum theory --- Molecular orbitals. --- 530.145 Quantum theory --- 541 Theoretical chemistry
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Molecular orbitals --- Orbites moléculaires --- 530.1 --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Quantum chemistry --- Valence (Theoretical chemistry) --- Wave mechanics --- Basic principles of physics --- 530.1 Basic principles of physics --- Orbites moléculaires
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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 book is a collection of selected papers on the Frontier Orbital Theory by Nobel prizewinner Kenichi Fukui (Chemistry 1981), with introductory notes. It provides the basic concept and formulation of the theory, and the physical and chemical significance of the frontier orbital interactions in chemistry, together with many practical applications. The formulation of the Intrinsic Reaction Coordinate and applications to some simple systems are also presented. The aim of this volume is to show by what forces chemical reactions are driven and to demonstrate how the regio- and stereo-selectivities are determined in chemical reactions. Students and senior investigators will gain insight into the nature of chemical reactions and find out how quantum chemical calculations are connected with chemical intuition.
Molecular orbitals. --- Chemical reactions. --- Physical organic chemistry. --- Chemistry, Physical organic --- Chemistry, Organic --- Chemistry, Physical and theoretical --- Reactions, Chemical --- Chemical processes --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Quantum chemistry --- Valence (Theoretical chemistry) --- Wave mechanics
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Quantum chemistry --- fysicochemie --- Physical organic chemistry --- Molecular orbitals --- Chimie organique physique --- Orbites moléculaires --- 519.68:547 --- Chemistry, Physical organic --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Valence (Theoretical chemistry) --- Wave mechanics --- Chemistry, Organic --- Chemistry, Physical and theoretical --- Computer programming-:-Organic chemistry --- Molecular orbitals. --- Physical organic chemistry. --- 519.68:547 Computer programming-:-Organic chemistry --- Orbites moléculaires --- Chemistry, physical organic
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Inorganic chemistry --- 546 --- Chemistry, Inorganic. --- Molecular orbitals. --- Quantum chemistry. --- 546 Inorganic chemistry --- Chemistry, Inorganic --- Molecular orbitals --- Quantum chemistry --- Chemistry, Quantum --- Chemistry, Physical and theoretical --- Quantum theory --- Excited state chemistry --- Chemistry --- Inorganic compounds --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Valence (Theoretical chemistry) --- Wave mechanics
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Quantum chemistry --- fysicochemie --- Electronics and optics of solids --- Crystallography --- Molecular orbitals --- Solids --- 538.9 --- Solid state physics --- Transparent solids --- Orbitals, Molecular --- Chemical bonds --- Electrons --- Molecules --- Overlap integral --- Valence (Theoretical chemistry) --- Wave mechanics --- Leptology --- Physical sciences --- Mineralogy --- Physics of condensed matter (in liquid state and solid state) --- Crystallography. --- Molecular orbitals. --- Solids. --- 538.9 Physics of condensed matter (in liquid state and solid state)
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