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Handbook of Relativistic Quantum Chemistry

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Cover of 'Handbook of Relativistic Quantum Chemistry'

Table of Contents

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    Book Overview
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    Chapter 1 With-Pair Relativistic Hamiltonians
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    Chapter 2 No-Pair Relativistic Hamiltonians:Q4C and X2C
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    Chapter 3 Sequential Decoupling of Negative-Energy States in Douglas–Kroll–Hess Theory
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    Chapter 4 Spin Separation of Relativistic Hamiltonians
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    Chapter 5 Relativistic Effective Core Potentials
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    Chapter 7 Basic Structures of RelativisticWave Functions
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    Chapter 8 Coalescence Conditions of Relativistic Wave Functions
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    Chapter 9 Relativistic Explicit Correlation: Problemsand Solutions
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    Chapter 12 Relativistic Methods for Calculating Electron Paramagnetic Resonance (EPR) Parameters
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    Chapter 16 Relativistic Theory of Nuclear Spin-Rotation Tensor
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    Chapter 17 Relativistic Theories of NMR Shielding
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    Chapter 18 Relativistic Density Functional Theory
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    Chapter 22 Dirac Operator and Its Properties
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    Chapter 23 Nuclear Charge Density and Magnetization Distributions
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    Chapter 24 Relativistic Self-Consistent Fields
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    Chapter 25 One-Particle Basis Sets for Relativistic Calculations
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    Chapter 26 QED Effects and Challenges
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    Chapter 27 Effective QED Hamiltonians
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    Chapter 28 Two-Time Greens Function Method
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    Chapter 29 Unifying Many-Body Perturbation Theory with Quantum Electrodynamics
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    Chapter 30 Relativistic Calculations of Atomic Clock
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    Chapter 31 Relativistic Many-Body Aspects of the Electron Electric Dipole Moment Searches Using Molecules
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    Chapter 33 Relativistic Equation-of-Motion Coupled-Cluster Theory (EOM-CC)
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    Chapter 34 High-Accuracy Relativistic Coupled-Cluster Calculations for the Heaviest Elements
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    Chapter 35 Relativistic Quantum Chemistry for Chemical Identification of the Superheavy Elements
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    Chapter 36 Introduction to Bound-State Quantum Electrodynamics
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    Chapter 37 Zero-Field Splitting in Transition Metal Complexes: Ab Initio Calculations, Effective Hamiltonians, Model Hamiltonians, and Crystal-Field Models
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