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Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science Book

Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science
Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science, Written by two researchers in the field, this book is a reference to explain the principles and fundamentals in a self-contained, complete and consistent way. Much attention is paid to the didactical value, with the chapters interconnected and based on ea, Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science has a rating of 4 stars
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Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science, Written by two researchers in the field, this book is a reference to explain the principles and fundamentals in a self-contained, complete and consistent way. Much attention is paid to the didactical value, with the chapters interconnected and based on ea, Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science
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  • Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science
  • Written by author Markus Reiher
  • Published by Wiley, John & Sons, Incorporated, March 2009
  • Written by two researchers in the field, this book is a reference to explain the principles and fundamentals in a self-contained, complete and consistent way. Much attention is paid to the didactical value, with the chapters interconnected and based on ea
  • Written by two researchers in the field, this book is a reference to explain the principles and fundamentals in a self-contained, complete and consistent way. Much attention is paid to the didactical value, with the chapters interconnected and based on ea
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Authors

1 Introduction 1

Pt. I Fundamentals 9

2 Elements of Classical Mechanics and Electrodynamics 11

3 Concepts of Special Relativity 51

4 Basics of Quantum Mechanics 113

Pt. II Dirac's Theory of the Electron 151

5 Relativistic Theory of the Electron 153

6 The Dirac Hydrogen Atom 183

Pt. III Four-Component Many-Electron Theory 225

7 Quantum Electrodynamics 227

8 First-Quantized Dirac-Based Many-Electron Theory 239

9 Many-Electron Atoms 315

10 General Molecules and Molecular Aggregates 385

Pt. IV Two-Component Hamiltonians 413

11 Decoupling the Negative-Energy States 415

12 Douglas-Kroll-Hess Theory 447

13 Elimination Techniques 479

Pt. V Chemistry with Relativistic Hamiltonians 503

14 Special Computational Techniques 505

15 External Electromagnetic Fields and Molecular Properties 517

16 Relativistic Effects in Chemistry 555

App. A Vector and Tensor Calculus 581

App. B Kinetic Energy in Generalized Coordinates 589

App. C Technical Proofs for Special Relativity 591

App. D Relations for Pauli and Dirac Matrices 597

App. E Fourier Transformations 601

App. F Discretization and Quadrature Schemes 605

App. G List of Abbreviations and Acronyms 611

App. H List of Symbols 613

References 615


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Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science, Written by two researchers in the field, this book is a reference to explain the principles and fundamentals in a self-contained, complete and consistent way. Much attention is paid to the didactical value, with the chapters interconnected and based on ea, Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science

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Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science, Written by two researchers in the field, this book is a reference to explain the principles and fundamentals in a self-contained, complete and consistent way. Much attention is paid to the didactical value, with the chapters interconnected and based on ea, Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science

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Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science, Written by two researchers in the field, this book is a reference to explain the principles and fundamentals in a self-contained, complete and consistent way. Much attention is paid to the didactical value, with the chapters interconnected and based on ea, Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science

Relativistic Quantum Chemistry: The Fundamental Theory of Molecular Science

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