{"product_id":"electronic-structure-and-properties-of-transition-metal-compounds-theory-and-applications-hardback-9781394178896","title":"Electronic Structure and Properties of Transition Metal Compounds; Theory and Applications (Hardback) 9781394178896","description":"\u003cfont face=\"Georgia\"\u003e\r\n\u003cp\u003e\u003cfont size=\"6\"\u003eElectronic Structure and Properties of Transition Metal Compounds\u003c\/font\u003e\u003cbr\u003e\r\n\u003cfont size=\"5\"\u003eTheory and Applications\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\r\n\r\n\r\n\u003cp\u003e\u003cfont size=\"4\"\u003eIsaac B. Bersuker (Author), Yang Liu (Author)\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003e9781394178896, Wiley\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003eHardback, published 21 March 2025\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003e864 pages\u003cbr\u003e22.9 x 15.2 x 4.9 cm, 1.276 kg\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\r\n\r\n\r\n\r\n\u003cp align=\"justify\"\u003e\u003cstrong\u003e\u003cfont size=\"3\"\u003e\u003cp\u003e\u003cb\u003ePresents the latest achievements in the theory of electronic structure and properties of transition metal coordination compounds with applications to a range of chemical and physical problems\u003c\/b\u003e \u003c\/p\u003e\n\u003cp\u003e\u003ci\u003eElectronic Structure and Properties of Transition Metal Compounds\u003c\/i\u003e offers a detailed and authoritative account of the theory of electronic structure and the properties of transition metal compounds with applications to various chemical and physical problems. \u003c\/p\u003e\n\u003cp\u003eThe fully updated third edition incorporates recent developments and methods in the field, including new coverage of methods of \u003ci\u003eab initio\u003c\/i\u003e calculations of the electronic structure of coordination compounds and the application of vibronic coupling and the Jahn-Teller effect to solve coordination chemistry problems. Revised chapters provide up-to-date views on reactivity, chemical activation, and catalysis. New and expanded questions, exercises, and problems in each chapter are supported by new problem-solving examples, illustrations, graphic presentations, and references. \u003c\/p\u003e\n\u003cp\u003eDesigned to be intelligible to advanced students, researchers, and instructors, \u003ci\u003eElectronic Structure and Properties of Transition Metal Compounds:\u003c\/i\u003e \u003c\/p\u003e\n\u003cul\u003e\n\u003cli\u003eProvides thorough coverage of the theory underlying the electronic structure and properties of transition metal compounds, including the physical methods of their investigation\u003c\/li\u003e\n\u003cli\u003eHelps readers understand the origin of observable properties in transition metal compounds and choose a suitable method of their investigation\u003c\/li\u003e\n\u003cli\u003eContains numerous problems with solutions and illustrative examples demonstrating the application of the theory to solving specific chemical and physical problems\u003c\/li\u003e\n\u003cli\u003ePresents a generalized view of the modern state of the field, beginning from the main ideas of quantum chemistry and atomic states to applications to various chemical and physical problems \u003c\/li\u003e\n\u003cli\u003eFeatures novel problems never fully considered in books on coordination chemistry, such as relativistic effects in bonding, optical band shapes, and electron transfer in mixed-valence compounds\u003c\/li\u003e\n\u003c\/ul\u003e \u003cp\u003e\u003ci\u003eElectronic Structure and Properties of Transition Metal Compounds: Theory and Applications, Third Edition\u003c\/i\u003e is an excellent textbook for graduate and advanced undergraduate chemistry students, as well as a useful reference for inorganic, bioinorganic, coordination, organometallic, and physical chemists and industrial and academic researchers working in catalysis, organic synthesis, materials science, and physical methods of investigation.\u003c\/p\u003e\u003c\/font\u003e\u003c\/strong\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003e\u003cp\u003ePreface to the Third Edition xvii\u003c\/p\u003e \u003cp\u003eExtract from the Preface to the Second Edition xix\u003c\/p\u003e \u003cp\u003eExtracts from the Preface to the First Edition xxiii\u003c\/p\u003e \u003cp\u003eForeword to the First Edition xxv\u003c\/p\u003e \u003cp\u003eMathematical Symbols xxvii\u003c\/p\u003e \u003cp\u003eAbbreviations xxxiii\u003c\/p\u003e \u003cp\u003e\u003cb\u003e1 Introduction: Subject and Methods 1\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e1.1 Objectives 1\u003c\/p\u003e \u003cp\u003e1.2 Definitions of Chemical Bonding and Transition Metal Coordination System 8\u003c\/p\u003e \u003cp\u003e1.3 The Schrödinger Equation 13\u003c\/p\u003e \u003cp\u003eSummary Notes 16\u003c\/p\u003e \u003cp\u003eReferences 17\u003c\/p\u003e \u003cp\u003e\u003cb\u003e2 Atomic States 19\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e2.1 One-Electron States 19\u003c\/p\u003e \u003cp\u003e2.2 Multielectron States: Energy Terms 38\u003c\/p\u003e \u003cp\u003eSummary Notes 54\u003c\/p\u003e \u003cp\u003eQuestions 55\u003c\/p\u003e \u003cp\u003eExercises and Problems 55\u003c\/p\u003e \u003cp\u003eReferences 56\u003c\/p\u003e \u003cp\u003e\u003cb\u003e3 Symmetry Ideas and Group-Theoretical Description 59\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e3.1 Symmetry Transformations and Matrices 60\u003c\/p\u003e \u003cp\u003e3.2 Groups of Symmetry Transformations 66\u003c\/p\u003e \u003cp\u003e3.3 Classification of Point Groups 67\u003c\/p\u003e \u003cp\u003e3.4 Representations of Groups and Matrices of Representations 71\u003c\/p\u003e \u003cp\u003e3.5 Classification of Molecular Terms and Vibrations, Selection Rules, and The Wigner–Eckart Theorem 78\u003c\/p\u003e \u003cp\u003e3.6 Construction of Symmetrized Molecular Orbitals and Normal Vibrations 83\u003c\/p\u003e \u003cp\u003e3.7 The Notion of Double Groups 92\u003c\/p\u003e \u003cp\u003eSummary Notes 93\u003c\/p\u003e \u003cp\u003eExercises and Problems 94\u003c\/p\u003e \u003cp\u003eReferences 95\u003c\/p\u003e \u003cp\u003e\u003cb\u003e4 Crystal Field Theory 97\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e4.1 Introduction 97\u003c\/p\u003e \u003cp\u003e4.2 Splitting of the Energy Levels of One d Electron in Ligand Fields 99\u003c\/p\u003e \u003cp\u003e4.3 Several d Electrons 114\u003c\/p\u003e \u003cp\u003e4.4 f-Electron Term Splitting 134\u003c\/p\u003e \u003cp\u003e4.5 Crystal Field Parameters and Extrastabilization Energy 137\u003c\/p\u003e \u003cp\u003e4.6 Limits of Applicability of Crystal Field Theory 141\u003c\/p\u003e \u003cp\u003eSummary Notes 143\u003c\/p\u003e \u003cp\u003eQuestions 144\u003c\/p\u003e \u003cp\u003eExercises and Problems 145\u003c\/p\u003e \u003cp\u003eReferences 146\u003c\/p\u003e \u003cp\u003e\u003cb\u003e5 Molecular Orbitals and Related Description of Electronic Structure 149\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e5.1 Basic Ideas of the MO LCAO Method 149\u003c\/p\u003e \u003cp\u003e5.2 Charge Distribution and Bonding in the MO LCAO Method. The Case of Weak Covalency 161\u003c\/p\u003e \u003cp\u003e5.3 Methods of Calculation of MO Energies and LCAO Coefficients 173\u003c\/p\u003e \u003cp\u003e5.4 Density Functional Theory 192\u003c\/p\u003e \u003cp\u003e5.5 Electronic Structure Calculations for Large Polyatomic Systems 209\u003c\/p\u003e \u003cp\u003e5.6 Comparison of Methods and Computer Programs 232\u003c\/p\u003e \u003cp\u003eSummary Notes 239\u003c\/p\u003e \u003cp\u003eExercises and Problems 240\u003c\/p\u003e \u003cp\u003eReferences 241\u003c\/p\u003e \u003cp\u003e\u003cb\u003e6 Electronic Structure and Chemical Bonding 249\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e6.1 Classification of Chemical Bonds by Electronic Structure and Role of \u003ci\u003ed\u003c\/i\u003e and \u003ci\u003ef\u003c\/i\u003e Electrons in Coordination Bonding 249\u003c\/p\u003e \u003cp\u003e6.2 Qualitative Aspects and Electronic Configurations 258\u003c\/p\u003e \u003cp\u003e6.3 Ligand Bonding 267\u003c\/p\u003e \u003cp\u003e6.4 Energies, Geometries, and Charge Distributions 303\u003c\/p\u003e \u003cp\u003e6.5 Relativistic Effects 315\u003c\/p\u003e \u003cp\u003eSummary Notes 332\u003c\/p\u003e \u003cp\u003eExercises and Problems 333\u003c\/p\u003e \u003cp\u003eReferences 335\u003c\/p\u003e \u003cp\u003e\u003cb\u003e7 Vibronic Coupling in Formation, Deformation, and Transformation of Polyatomic Systems. The Jahn–Teller Effects 343\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e7.1 Molecular Vibrations 344\u003c\/p\u003e \u003cp\u003e7.2 Vibronic Coupling 356\u003c\/p\u003e \u003cp\u003e7.3 The Jahn–Teller Effects 363\u003c\/p\u003e \u003cp\u003e7.4 Pseudo-Jahn–Teller Effect and the Two-Level Paradigm 396\u003c\/p\u003e \u003cp\u003eSummary Notes 415\u003c\/p\u003e \u003cp\u003eExercises and Problems 416\u003c\/p\u003e \u003cp\u003eReferences 417\u003c\/p\u003e \u003cp\u003e\u003cb\u003e8 Electronic Structure Investigated by Physical Methods 421\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e8.1 Band Shapes of Electronic Spectra 422\u003c\/p\u003e \u003cp\u003e8.2 \u003ci\u003ed–d\u003c\/i\u003e, Charge Transfer, Infrared, and Raman Spectra 436\u003c\/p\u003e \u003cp\u003e8.3 X-ray and Ultraviolet Photoelectron Spectra; EXAFS 457\u003c\/p\u003e \u003cp\u003e8.4 Magnetic Properrties 474\u003c\/p\u003e \u003cp\u003e8.5 Gamma-resonance Spectroscopy 503\u003c\/p\u003e \u003cp\u003e8.6 Electron Charge and Spin Density distribution in Diffraction Method 514\u003c\/p\u003e \u003cp\u003eSummary Notes 526\u003c\/p\u003e \u003cp\u003eExercises and Problems 528\u003c\/p\u003e \u003cp\u003eReferences 532\u003c\/p\u003e \u003cp\u003e\u003cb\u003e9 Stereochemistry and Crystal Chemistry 539\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e9.1 Definitions. Semiclassical Approaches 539\u003c\/p\u003e \u003cp\u003e9.2 Vibronic Effects in Stereochemistry 555\u003c\/p\u003e \u003cp\u003e9.3 Mutual Influence of Ligands 580\u003c\/p\u003e \u003cp\u003e9.4 Crystal Stereochemistry 591\u003c\/p\u003e \u003cp\u003ePhase Transitions and Helicoidal Structures 603\u003c\/p\u003e \u003cp\u003eSummary Notes 610\u003c\/p\u003e \u003cp\u003eExercises and Problems 612\u003c\/p\u003e \u003cp\u003eReferences 613\u003c\/p\u003e \u003cp\u003e\u003cb\u003e10 Charge Transfer, Redox Properties, and Electron-conformational Effects 619\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e10.1 Electron Transfer and Charge Transfer by Coordination 619\u003c\/p\u003e \u003cp\u003e10.2 Electron Transfer in Mixed-Valence Compounds 633\u003c\/p\u003e \u003cp\u003e10.3 Electron-Conformational Effects In Biological Systems 652\u003c\/p\u003e \u003cp\u003eSummary Notes 661\u003c\/p\u003e \u003cp\u003eExercises and Problems 662\u003c\/p\u003e \u003cp\u003eReferences 663\u003c\/p\u003e \u003cp\u003e\u003cb\u003e11 Reactivity and Catalytic Action 667\u003c\/b\u003e\u003c\/p\u003e \u003cp\u003e11.1 Electronic Factors in Reactivity 667\u003c\/p\u003e \u003cp\u003e11.2 Electronic Control of Chemical Activation Via Vibronic Coupling 682\u003c\/p\u003e \u003cp\u003e11.3 Direct Computation of Energy Barriers of Chemical Reactions 706\u003c\/p\u003e \u003cp\u003eSummary Notes 733\u003c\/p\u003e \u003cp\u003eQuestions and Problems 734\u003c\/p\u003e \u003cp\u003eReferences 736\u003c\/p\u003e \u003cp\u003eAppendix 1. Tables of Characters of Irreducible Representations of Most Usable Symmetry Point Groups and Direct Products of Some Representations 741\u003c\/p\u003e \u003cp\u003eAppendix 2. General Expressions for the Matrix Element \u003ci\u003ev\u003csub\u003emm\u003c\/sub\u003e\u003c\/i\u003e of Perturbation of the States of one d Electron in Crystal Fields of Arbitrary Symmetry 747\u003c\/p\u003e \u003cp\u003eAppendix 3. Calculation of the Destabilization and Splitting of the States of One d Electron in Crystal Fields of Different Symmetries 751\u003c\/p\u003e \u003cp\u003eAppendix 4. Matrix Elements of Crystal Field Perturbation of a Two-Electron Term \u003ci\u003eF\u003c\/i\u003e(\u003ci\u003end\u003c\/i\u003e)\u003csup\u003e2\u003c\/sup\u003e, V\u003ci\u003e\u003csub\u003eij\u003c\/sub\u003e\u003c\/i\u003e , \u003ci\u003ei\u003c\/i\u003e, \u003ci\u003ej\u003c\/i\u003e = 1,2, …, 7 Expressed by One-Electron Matrix Elements \u003ci\u003eV\u003csub\u003emm\u003c\/sub\u003e\u003c\/i\u003e Given in Appendix 2 757\u003c\/p\u003e \u003cp\u003eAppendix 5. Matrix Elements of Crystal Field Perturbation of \u003ci\u003ef-Electron States 759\u003c\/i\u003e\u003c\/p\u003e \u003cp\u003eAnswers and Solutions 763\u003c\/p\u003e \u003cp\u003eSubject Index 817\u003c\/p\u003e\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\u003cp\u003e\u003cfont size=\"3\"\u003eSubject Areas: Chemistry [\u003ca title=\"See our other books on Chemistry\" href=\"https:\/\/freshlyprintedbooks.co.uk\/search?q=%22Chemistry%20%5BPN%5D%22\"\u003ePN\u003c\/a\u003e]\u003c\/font\u003e\u003c\/p\u003e\r\n\r\n\r\n\u003c\/font\u003e","brand":"Wiley","offers":[{"title":"Brand New","offer_id":52502950150424,"sku":"9781394178896","price":142.28,"currency_code":"GBP","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0730\/2037\/5320\/files\/9781394178896.jpg?v=1786320552","url":"https:\/\/freshlyprintedbooks.co.uk\/products\/electronic-structure-and-properties-of-transition-metal-compounds-theory-and-applications-hardback-9781394178896","provider":"Freshly Printed Books","version":"1.0","type":"link"}