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Ziems, Karl Michael
2019
Table of Contents:
“...Theoretical Background of Quantum Chemistry -- Computational Details -- Results for Heavy Atom Mechanism -- Results for Chemical Reduction Mechanism....”2019
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Liu, Wenjian
2019
Table of Contents:
“...From the Contents: Volume I Fundamentals of relativistic quantum mechanics -- Introduction to relativistic quantum chemistry -- Concepts of special relativity -- The Dirac operator and its essential properties -- Nuclear charge and magnetization...”2019
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Putz, Mihai V.
2018
Table of Contents:
“...Atomic Structure and Quantum Mechanics -- Wave Function Theories and Electron Structure Methods. Quantum Chemistry, from Atoms to Molecules -- Density Functional Theory: from conceptual level towards practical functionality -- Bond! Chemical Bond...”2018
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Kirtman, Bernard
2018
Table of Contents:
“... -- Embedding Methods in Quantum Chemistry -- Calculation of Vibrational Spectra of Large Molecules from their Fragments -- Describing Molecules in Motion by Quantum Many-Body Methods -- Relativistic Time-Dependent Density-Functional Theory for Molecular Properties...”2018
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Califano, Salvatore.
2012
Table of Contents:
“...Chemistry and Energy -- Kinetics and Chemical Equilibrium -- Matter and Electricity -- Chemical Physics Structural Techniques -- The Electron and the Atomic Structure -- Radioactivity -- From Quantum Mechanics to Quantum Chemistry -- The Mechanisms...”2012
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