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  • Quantum Chemistry

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Quantum Chemistry

4.4 out of 5 stars (243)

Still a best-selling text after a remarkable twenty-four years in print, Don McQuarrie has now updated his landmark Quantum Chemistry into a keenly anticipated second edition. Perhaps the biggest change in the years since the first edition appeared is the proliferation of computational chemistry programs that are available to calculate molecular properties. McQuarrie has presented step-by-step SCF calculations of a helium atom in Chapter 9 and a hydrogen molecule in Chapter 10, in addition to including an entire chapter on the Hartree-Fock method and post-Hartree-Fock methods for the calculation of molecular properties. Most molecular calculations nowadays use Gaussian orbitals, and they are introduced here along with the common notation such as HF / STO-6G and HF / 6-31G** to describe the types of calculations involving Gaussian orbitals. The final sections discuss configuration interaction, coupled-cluster theory and density functional theory, at least semi-quantitatively, so that the reader can be aware of the computational methods that are being used currently. Terrminology such as CISD, CCSD, and BLPY / 6-31G* is introduced and hands-on molecular calculations for all these methods using computational chemistry programs such as Gaussian and WebMo for a variety of molecules is presented. The book also uses problems to encourage the use of an invaluable National Institute of Science and Technology ( NIST ) website that lists experimental data and the results of various ab initio calculations for hundreds of molecules. Other changes include the discussion of molecular spectroscopy throughout the chapters on the harmonic oscillator and the rigid-rotator. The hydrogen atom, along with its electronic spectroscopy, is discussed in a separate chapter. And in the following chapter, which is devoted entirely to multielectron atoms, a website for Hartree-Fock atomic orbitals is introduced. After learning the structure of these atomic orbitals, they are used to calculate atomic properties for multielectron atoms. The new edition also includes a series of short interchapters call MathChapters placed throughout the book to help students focus on the physical principles being explained rather than struggling with the underlying mathematics. As with the first edition, the book assumes a prerequisite of one year of calculus with no required knowledge of differential equations. Each chapter includes a broad range of problems and exercises. Answers to numerical problems are at the back of the book and a detailed Solutions Manual, by Mark Marshall and Helen Leung of Amherst College, will also be available.
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Editorial Reviews

Review

"The strong points of the book are what one might expect from McQuarrie: very clear mathematical derivations and excellent problems." -- David Case, UC Davis

"This text is a bargain in more ways than one." --
Journal of the American Chemical Society

About the Author

As the author of landmark chemistry books and textbooks, Donald McQuarrie's name is synonymous with excellence in chemical education. From his classic text on Statistical Mechanics to his recent quantum-first tour de force on Physical Chemistry, McQuarrie's best selling textbooks are highly acclaimed by the chemistry community. McQuarrie received his PhD from the University of Oregon, and is Professor Emeritus from the Department of Chemistry at the University of California, Davis. He makes his home at The Sea Ranch in California with his wife Carole, where he continues to write.

Product details

  • Publisher ‏ : ‎ Univ Science Books
  • Publication date ‏ : ‎ January 1, 1983
  • Language ‏ : ‎ English
  • Print length ‏ : ‎ 517 pages
  • ISBN-10 ‏ : ‎ 093570213X
  • ISBN-13 ‏ : ‎ 978-0935702132
  • Item Weight ‏ : ‎ 2 pounds
  • Dimensions ‏ : ‎ 7 x 1.25 x 9.75 inches
  • Best Sellers Rank: #887,187 in Books (See Top 100 in Books)
  • Customer Reviews:
    4.4 out of 5 stars (243)

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Donald A. McQuarrie
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Customer reviews

4.4 out of 5 stars
243 global ratings
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Customers say

Customers highly recommend this quantum chemistry textbook, particularly as a great introduction to the subject. One customer notes that it makes quantum chemistry almost easy to understand, while another appreciates its clear math derivations.
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7 customers mention recommendation, 7 positive, 0 negative
Customers highly recommend this textbook, with one noting it is one of the better QM books.
All chemists schould read this book. I highly recommend this text.Read more
...I highly recommend this book to Chemistry majors, Materials Science, Nano, etc. i.e. because they are less mathematically trained than physicists.Read more
...The author is very clear, thorough, and easy to follow. Highly recommended for physicists, chemists, and materials engineers alike.Read more
...Recommended for any undergrad chem/biochem/biology majors.Read more
5 customers mention content, 5 positive, 0 negative
Customers find the book provides a great introduction to Quantum Physics, with one customer noting it excels in clear math derivations.
...a very suitable textbook for chemistry students as it takes in account the math background of a normal chemistry student and developed the math...Read more
This is a great introduction for Quantum Physics. It is not nearly as rigorous as the Physics books, and is actually enjoyable to read....Read more
This is an excellent introduction to quantum chemistry. Mcquarrie writes clearly and makes quantum chemistry almost easy....Read more
...this book is geared toward chemists, but the quantum principles described in the book apply to everyone....Read more

Top reviews from the United States

  • 5 out of 5 stars
    excellent textbook for chemistry students
    Reviewed in the United States on September 18, 2011
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    This is my first time writing a review and I hope a rookie like me can appropriately describe this book's excellence. It's a very suitable textbook for chemistry students as it takes in account the math background of a normal chemistry student and developed the math derivation based upon this background. As quantum mechanics is in nature mathematics (this was said by Linus Pauling in his book on "introduction to quantum mechanics and its application on chemistry"), math is something that we cannot avoid to understand quantum mechanics itself. Donald's book excels in very clear math derivation which helps to unveil the myth of quantum mechanics as well as interpreting the physical meaning of math derivation which is directly related to practical applications. In that sense, this book is also good for students who have other majors but want to study quantum chemistry as the book is faithful to the idea of applying quantum mechanics to chemistry problems.

    4 people found this helpful
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  • 5 out of 5 stars
    This is a very good book.
    Reviewed in the United States on February 20, 2025
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    All chemists schould read this book. I highly recommend this text.

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  • 4 out of 5 stars
    Baby's First Quantum Chemistry Book
    Reviewed in the United States on November 18, 2006
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    This is an excellent introduction to quantum chemistry. Mcquarrie writes clearly and makes quantum chemistry almost easy. It's not a graduate level text and any graduate courses using it will have to be heavily supplimented due to the limited range of subjects in the book. I have three quantum chemistry books: this, Levine, and Atkins (molecular quantum mechanics). Of the three this is the easiest to understand, followed by Levine and then by Atkins. My two gripes with this text is the limited range and the heavy skipping of derivations. Mcquarrie tries to baby-step the reader through his text but sometimes totally skips some derivations. Levine becomes easier to understand in that respect. I don't mind it if the author sometimes skips steps during a derivation, but when he leaves everything out, that doesn't help with the understanding. He states that they're easy and rightly, they are. But assuming too much about the ability of the student is not the hallmark of a teacher. Intro to quantum chem is simple enough a subject to not have to make such an assumption. Recommended for any undergrad chem/biochem/biology majors.

    6 people found this helpful
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  • 5 out of 5 stars
    One of the better QM books
    Reviewed in the United States on September 22, 2015
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    In a World Gone Mad One Quantum Book Stands Above The Rest!

    When I took QM I suffered through other books before finding this one after the course was over. It was my first McQuarrie book but not my last as I went on to use and enjoy his Statistical Mechanics book and wish I had read his Physical Chemistry instead of the Telephone Book Atkins has become.

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  • 5 out of 5 stars
    Chemists can just write better that physicists...
    Reviewed in the United States on November 15, 2008
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    Granted this book is geared toward chemists, but the quantum principles described in the book apply to everyone. The author is very clear, thorough, and easy to follow. Highly recommended for physicists, chemists, and materials engineers alike.

    5 people found this helpful
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  • 4 out of 5 stars
    It's a good buy! A must for non-physicist quantum mechanics.
    Reviewed in the United States on May 12, 2017
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    I didn't find any publisher info in the book, which is weird. Nonetheless, the content is great and for the price, better! With good care, one should not have any problems with this book. I bought it to study independently before taking Quantum Mechanics next year. I've already gone through the first chapters and everything is going well. I highly recommend this book to Chemistry majors, Materials Science, Nano, etc. i.e. because they are less mathematically trained than physicists.

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  • 5 out of 5 stars
    Five Stars
    Reviewed in the United States on July 26, 2017
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    it is a good item

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  • 4 out of 5 stars
    Quantum Physics for the Non Physiscist
    Reviewed in the United States on July 31, 2008
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    This is a great introduction for Quantum Physics. It is not nearly as rigorous as the Physics books, and is actually enjoyable to read. I recommend reading this before taking quantum physics, or concurrently.

    4 people found this helpful
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  • 5 out of 5 stars
    Good quality
    Reviewed in Germany on October 10, 2019
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    The book is what we were expecting

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  • 5 out of 5 stars
    tutto a posto
    Reviewed in Italy on June 3, 2021
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    tutto a posto

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  • 5 out of 5 stars
    Highly logical and advanced.
    Reviewed in India on January 28, 2025
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    The book is highly mathematical in nature and before reading the book students should brush up their mathematical skills. The book is mostly based on calculus and linear algebra. The problem sections are really good and challenging which includes numericals and proof based questions.

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  • 4 out of 5 stars
    ha un cattivo odore
    Reviewed in Italy on September 3, 2024
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    Odore di terrore misto a lacrime, ma nonostante ciò ti invita ad una comprensione relativamente immediata. Buon prezzo e buon libro

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  • 5 out of 5 stars
    Good and fast service
    Reviewed in Germany on January 21, 2020
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    Good book and good service.

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