Applications of Quantum Dynamics in Chemistry

By Hans-Dieter Meyer, Andre Nauts, Fabien Gatti, et al.

Book Overview

Part I Introduction.- Part II Concepts and Methods: Quantum effects.- Electronic states and potential energy operators.- The Choice of coordinates.- Kinetic energy operators.- Introduction to molecular symmetry.- Introduction to numerical methods and to MCTDH.- Part III Applications: Infrared spectroscopy.- Quantum control with laser pulses in the electronic ground state.- Photodissociation spectra.- Cross sections for reactive scattering.- Quantum control with laser pulses for electronically excited states.- Non-adiabatic photochemistry.- Optimal control and quantum computers.- Part IV Conclusion.

• Format: Hardcover
• Language: English
• ISBN: 3319539213
• ISBN13: 9783319539218
• Release Date: September 2017
• Publisher: Springer
• Length: 429 Pages
• Weight: 1.76 lbs.
• Dimensions: 1.0" x 6.1" x 9.2"