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Balancing quantum theory with practical experiments, this book focuses on the theory involved in determining and converting measured and computed data sets into accurate and well-defined equilibrium structures. It discusses quantum chemistry, the method of least squares, and computational aspects of determining semi-experimental equilibrium structures. It also explains the determination of moments of inertia from spectra as well as the determination of diatomic molecular potentials using semi-classical and quantum mechanical methods. A CD-ROM contains additional examples, making the book ideal…mehr

Produktbeschreibung
Balancing quantum theory with practical experiments, this book focuses on the theory involved in determining and converting measured and computed data sets into accurate and well-defined equilibrium structures. It discusses quantum chemistry, the method of least squares, and computational aspects of determining semi-experimental equilibrium structures. It also explains the determination of moments of inertia from spectra as well as the determination of diatomic molecular potentials using semi-classical and quantum mechanical methods. A CD-ROM contains additional examples, making the book ideal for class instruction or self-instruction. This text is suitable for newcomers and experienced spectroscopists who want to expand their area of knowledge.

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