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Quantum Chemistry - Hardcover By Donald A McQuarrie - ACCEPTABLE
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Specificaties
- Objectstaat
- Brand
- Unbranded
- Book Title
- Quantum Chemistry
- MPN
- Does not apply
- ISBN
- 9781891389504
- Subject Area
- Science
- Publication Name
- Quantum Chemistry
- Item Length
- 10.2 in
- Publisher
- University Science Books
- Subject
- Physics / Quantum Theory, Chemistry / General
- Publication Year
- 2007
- Type
- Textbook
- Format
- Hardcover
- Language
- English
- Item Height
- 1.7 in
- Features
- Revised
- Item Width
- 7 in
- Item Weight
- 0 Oz
- Number of Pages
- 746 Pages
Over dit product
Product Information
A best-selling text after twenty-four years in print, Don McQuarrie has 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. Terminology 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. In the following chapter, which is devoted 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 called MathChapters placed throughout the book to help students focus on the physical principles being explained rather than struggling with the underlying mathematics. This book assumes a prerequisite of one year of calculus with no required knowledge of differential equations. Each chapter includes a range of problems and exercises.
Product Identifiers
Publisher
University Science Books
ISBN-10
1891389505
ISBN-13
9781891389504
eBay Product ID (ePID)
61284468
Product Key Features
Publication Name
Quantum Chemistry
Format
Hardcover
Language
English
Features
Revised
Subject
Physics / Quantum Theory, Chemistry / General
Publication Year
2007
Type
Textbook
Subject Area
Science
Number of Pages
746 Pages
Dimensions
Item Length
10.2 in
Item Height
1.7 in
Item Width
7 in
Item Weight
0 Oz
Additional Product Features
Edition Number
2
LCCN
2007-023879
Lc Classification Number
Qd462.M4 2007
Edition Description
Revised Edition
Table of Content
1. The Dawn of Quantum TheoryMathChapter A: Complex Numbers2. The Classical Wave EquationMathChapter B: Probability & Statistics3. The Schrödinger Equation and a Particle in a BoxMathChapter C: Vectors4. The Postulates and General Principles of Quantum MechanicsMathChapter D: Series and Limits5. The Harmonic Oscillator and Vibrational SpectroscopyMathChapter E: Spherical Coordinates6. The Rigid Rotator and Rotational SpectroscopyMathChapter F: Determinants7. The Hydrogen AtomMathChapter G: Matrices8. Approximation MethodsMathChapter H: Matrix Eigenvalue Problems9. Many-Electron Atoms10. The Chemical Bond: One-and Two-Electron Molecules11. Qualitative Theory of Chemical BondingAppendicesSolutions of ProblemsIndex
Copyright Date
2007
Target Audience
College Audience
Dewey Decimal
541.2/8
Dewey Edition
19
Illustrated
Yes
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US $12,45 (ongeveer EUR 11,44) | Verenigde Staten | Standaardverzendservice (USPS Ground Advantage®) | Geschatte levering tussen za, 8 jun en do, 13 jun tot 43230 |
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