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  1. A frontier field beyond atom and molecular control will be concentrated on the controlling of nuclei. Both theoretical design and laboratory experiments extremely need to be developed with the great progress of quantum physics and laser technology.…
  2. This is the first book to present the necessary quantum chemical methods for both resonance types in one handy volume, emphasizing the crucial interrelation between NMR and EPR parameters from a computational and theoretical point of view. Here,…
  3. This widely adopted undergraduate-level text applies quantum mechanics to a broad range of chemical and physical problems, covering such subjects as wave functions for the hydrogen atom, perturbation theory, the Pauli exclusion principle, and the…
  4. For each of 150 landmark papers in ab initio molecular electronic structure methods, the author provides a lucid commentary. The primary focus is methodology, rather than particular chemical problems. The selected papers present important methods…
  5. Concerned strictly with the principles and formalism of quantum mechanics, this graduate student-oriented volume develops the subject as a fundamental discipline. Opening chapters review the origins of Schrdinger's equations and the nature of the…
  6. Graduate-level text explains modern in-depth approaches to the calculation of the electronic structure and properties of molecules. Hartree-Fock approximation, electron pair approximation, much more. Largely self-contained, only prerequisite is…
  7. Essentials of Computational Chemistry provides a balanced introduction to this dynamic subject. Suitable for both experimentalists and theorists, a wide range of samples and applications are included drawn from all key areas. The book carefully…
  8. We review the current status of quantum chemistry as a predictive tool of chemistry and molecular physics, capable of providing highly accurate, quantitative data about molecular systems. We begin by reviewing wave-function based…
  9. "Chemists familiar with conventional quantum mechanics will applaud and benefit greatly from this particularly instructive, thorough and clearly written exposition of density functional theory: its basis, concepts, terms, implementation, and…

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