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# π Fundamentals of Quantum Chemistry Molecular Spectroscopy and Modern Electronic Structure Computations by Michael Mueller β download pdf

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This text is designed as a practical introduction to quantum chemistry. Quantum chemistry is applied to explain and predict molecular spectroscopy and the electronic structure of atoms and molecules. In addition, the text provides a practical guide to using molecular mechanics and electronic structure computations including ab initio, semi-empirical, and density functional methods. The use of electronic structure computations is a timely subject as its applications in both theoretical and experimental chemical research is increasingly prevalent.This text is written in a format that fosters mastery of the subject both in competency in the mathematics and in obtaining a conceptual understanding of quantum mechanics. The chemistry student's interest is maintained early on in the text where quantum mechanics is developed by applying it to molecular spectroscopy and through conceptual questions labeled as Chemical Connection. Questions throughout the text labeled as Chemical Connection and Points of Further Understanding focus on conceptual understanding and consequences of quantum mechanics. If an Instructor chooses, these questions can be used as a basis for classroom discussion encouraging cooperative learning techniques.This text provides a solid foundation from which students can readily build further knowledge of quantum chemistry in more advanced courses. In cases where this is a final course in quantum chemistry, this text provides the student not only with an appreciation of the importance of quantum mechanics to chemistry, but also with a practical guide to using electronic structure computations.

## About book:

## About file:

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- Author:
**Michael Mueller** - Year:
**2001** - Publisher:
**Kap/Plenum (E)** - Language:
**English** - ISBN:
**9780306475665,0306475669**

- File size:
**6 316 462** - Format:
**pdf**

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Quantum chemical calculation method has become an indispensable tool in exploring chemistry. However, for the inborn difficulty of quantum chemistry the beginners hesitate to adopt this powerful tool in their research. This book provides various specific...

This is the first book to provide comprehensive treatment of the use of the symmetric group in quantum chemical structures of atoms, molecules, and solids. It begins with the conventional Slater determinant approach and proceeds to the basics of the symme...

This is the first book to provide comprehensive treatment of the use of the symmetric group in quantum chemical structures of atoms, molecules, and solids. It begins with the conventional Slater determinant approach and proceeds to the basics of the symme...

Computational molecular and materials modeling has emerged to deliver solid technological impacts in the chemical, pharmaceutical, and materials industries. It is not the all-predictive science fiction that discouraged early adopters in the 1980s. Rather,...

Quantum chemical calculation method has become an indispensable tool in exploring chemistry. However, for the inborn difficulty of quantum chemistry the beginners hesitate to adopt this powerful tool in their research. This book provides various specific...

This book delivers a comprehensive account of the main features and possibilities of LCAO methods for the first principles calculations of electronic structure of periodic systems. The first part describes the basic theory underlying the LCAO methods appl...

The rise of quantum electrodynamics (QED) made possible a number of excellent textbooks on quantum field theory in the 1960s. However, the rise of quantum chromodynamics (QCD) and the Standard Model has made it urgent to have a fully modern textbook for t...

This book displays the latest developments in the determinatioin of the electronic structure of solids and the physical properties which can be described from the electronic structure. Special emphasis is placed on the Linear Muffin Tin Orbital method for...

This volume constitutes the proceedings of the Nobel Laureate Symposium on Applied Quantum Chemistry held during the International Chemical Congress of Pacific Basin Societies, 16-21 December 1984, in Honolulu, Hawaii. The Symposium was held in honour of ...

Why do many athletes risk their careers by taking performance-enhancing drugs? Do the highly competitive pressures of elite sports teach athletes to win at any cost? An Introduction to Drugs in Sport provides a detailed and systematic examination of dru...

English Language and its usage have become extremely emotive issues in recent years.ΠΒ Recurring discussions in the media have highlighted a growing demand for a return to the study of language after decades of neglect.An Introduction to English Grammar i...

This is an average book. But I liked the Distributed Algorithms by Nancy Lynch better. It is a much better presented book that this one though most of the material covered is the same give or take a few. Over all a good book worth the money but there are ...

This book had many obtuse examples that did not support the points being made. It wandered all over the place with no real organized format. There was no stepping stone approach. Frequently the examples were gramatically incorrect. The professor spent...

In this third edition of his popular undergraduate-level textbook, Des Nicholl recognises that a sound grasp of basic principles is vital in any introduction to genetic engineering. Therefore, as well as being thoroughly updated, the book also retains its...

The concept of fuzzy sets is one of the most fundamental and influential tools in computational intelligence. Fuzzy sets can provide solutions to a broad range of problems of control, pattern classification, reasoning, pl...

This book is intended to be an introduction to Delay Differential Equations for upper level undergraduates or beginning graduate mathematics students who have a good background in ordinary differential equations and would like to learn about the applicati...

This is a completely revised edition of a comprehensive and popular introduction to the fast moving area of Forensic Genetics. The text begins with key concepts needed to fully appreciate the subject and moves on to examine the latest developments in the ...