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Introduction to Quantum Mechanics in Chemistry
- Careful Pedagogy. Worked examples in every chapter give students hands on problem solving experience. Ex.___ End-of-chapter problems, with answers to odd-numbered problems in an appendix.
- Worked examples in every chapter give students hands on problem solving experience. Ex.___
- End-of-chapter problems, with answers to odd-numbered problems in an appendix.
- One chapter (Chapter 14) devoted exclusively to solving a series of quantum mechanical problems with computers—Connects the previously learned theory with practical and real problems. Allows students to use and understand any current software application for electronic structure calculations (e.g. Gaussian, Jaguar, GAMESS, Q-Chem). Ex.___
- Allows students to use and understand any current software application for electronic structure calculations (e.g. Gaussian, Jaguar, GAMESS, Q-Chem). Ex.___
- Focused presentation. Allows students to concentrate on technique and methods without weeding through excess reading material. Ex.___
- Allows students to concentrate on technique and methods without weeding through excess reading material. Ex.___
- Does not require math beyond undergraduate calculus. Makes this a less intimidating book that can be used by students in all areas of specialization, including synthetic chemistry. Ex.___
- Makes this a less intimidating book that can be used by students in all areas of specialization, including synthetic chemistry. Ex.___
- Unique treatment of spectroscopy of polyatomic molecules (Chapter 15). Gives students a rigorous yet conceptually straightforward treatment of the spectroscopy of polyatomic molecules, which can get very complicated.
- Gives students a rigorous yet conceptually straightforward treatment of the spectroscopy of polyatomic molecules, which can get very complicated.
- The newest text on the market. The most up-to-date book in an area where software capabilities are changing rapidly. Allows students to use the most recent software to the limits of its capabilities.
- Allows students to use the most recent software to the limits of its capabilities.
This book serves as a self-study guide to familiarize users with the crucial language of modern chemistry science. It provides a background of electronic structure programs, and includes worked examples in problem solving and computer exercises. For computational chemists, materials scientists, and chemical engineers who want to learn more about their field without unnecessary complexity, detail, or formalism.
