did-you-know? rent-now

Amazon no longer offers textbook rentals. We do!

did-you-know? rent-now

Amazon no longer offers textbook rentals. We do!

We're the #1 textbook rental company. Let us show you why.

9781420052121

DV-X a Molecular Orbital Calculation Method

by ;
  • ISBN13:

    9781420052121

  • ISBN10:

    1420052128

  • Format: Hardcover
  • Copyright: 2009-07-30
  • Publisher: CRC
  • Purchase Benefits
  • Free Shipping Icon Free Shipping On Orders Over $35!
    Your order must be $35 or more to qualify for free economy shipping. Bulk sales, PO's, Marketplace items, eBooks and apparel do not qualify for this offer.
  • eCampus.com Logo Get Rewarded for Ordering Your Textbooks! Enroll Now
  • Write a Review Icon Write a Review
List Price: $129.95
We're Sorry.
No Options Available at This Time.

Summary

This book describes the basic aspects of molecular orbital calculations based on quantum mechanics, including both time-independent and time-dependent formalisms, and explains how to calculate an electric dipole transition and an electronic structure under an electric field. The authors discuss basic quantum mechanics, explain how to modify the basic quantum mechanical equations for use in computer calculations, and provide numerical examples of calculations that can be performed easily using programs such as Excel'„¢. This unique text will be of interest to professionals and students in many fields including quantum science and chemistry, mathematics, computer programming, and engineering.

Table of Contents

Atom Calculation Method. Molecule Calculation Method. Electric Dipole Transition for Spectral Analysis. Coulomb and Exchange Integrals. Symmetry Calculation Method for Cluster Approximation of Solid. Electronic Structure of Molecules Under an Electric Field.

Supplemental Materials

What is included with this book?

The New copy of this book will include any supplemental materials advertised. Please check the title of the book to determine if it should include any access cards, study guides, lab manuals, CDs, etc.

The Used, Rental and eBook copies of this book are not guaranteed to include any supplemental materials. Typically, only the book itself is included. This is true even if the title states it includes any access cards, study guides, lab manuals, CDs, etc.

Rewards Program