Table of Contents: “...Response Theory: Properties and Spectra -- On Gauge Invariance and Molecular Electrodynamics -- Quantum Mechanics of Electro-Nuclear Systems Towards a Theory of Chemical Reactions -- Theoretical Study of Regularities in Atomic and Molecular Spectral...”

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Table of Contents: “...Theoretical Study of Reactions Catalyzed by Acidic Zeolite -- Quantum Chemical Modeling the Location of Extraframework Metal Cations in Zeolites -- Chemical Reactions of Alkanes Catalysed by Zeolites -- Ab Initio Simulations of Zeolite Reactivity...”

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Table of Contents: “...-Layer Electrostatic Effects in Electrochemistry -- Reactive Collisions and Chemical Reactions -- Electro-Nuclear Quantum Mechanics Beyond the Born-Oppenheimer Approximation. Towards a Quantum Electronic Theory of Chemical Reaction Mechanisms -- MCSCF Study...”

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Table of Contents: “...*The European Workshop “Quantum Systems in Chemistry and Physics” -- *Separability in Quantum Mechanics -- *Optimized Effective Potential for Atoms and Molecules -- *The Relativistic Quantum Defect Orbital Method and Some of its Applications -- *A New...”

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Table of Contents: “...Introductory remarks -- An overview of molecular quantum mechanics -- The Born-Oppenheimer approximation -- The electron correlation problem -- Unitary group approach to the many-electron correlation problem -- The configuration interaction approach...”

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Table of Contents: “... Molecular Structure Calculations -- 1. Introduction -- 2. Relativistic Molecular Quantum Mechanics -- 3. Relativistic Independent Electron Models -- 4. Electron Correlation -- 5. The Algebraic Approximation -- 6. Conclusions and Future Prospects -- References...”

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Table of Contents: “...I. Basics -- 1. Introduction -- 2. Chemistry by Computer. -- 3. Computers and Computation -- II. Methods -- 4. Quantum Chemistry -- 5. Molecular Mechanics -- 6. Chemical Reactions -- 7. Simulation of Liquids and Solids -- III. Applications -- 8...”

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