9783527410699

Atomistic Computer Simulations : A Practical Guide

  • ISBN 13:

    9783527410699

  • ISBN 10:

    3527410694

  • Format: Paperback
  • Copyright: 04/15/2013
  • Publisher: Vch Pub

Note: Not guaranteed to come with supplemental materials (access cards, study guides, lab manuals, CDs, etc.)

Extend Your Rental at Any Time

Need to keep your rental past your due date? At any time before your due date you can extend or purchase your rental through your account.

Sorry, this item is currently unavailable.

Summary

This introductory "how to" title enables readers to understand, plan, run, and analyze their own independent atomistic simulations, and decide which method to use and which questions to ask in their research project. It is written in a clear and precise language, focusing on a thorough understanding of the concepts behind the equations and how these are used in the simulations. As a result, readers will learn how to design the computational model and which parameters of the simulations are essential, as well as being able to assess whether the results are correct, find and correct errors, and extract the relevant information from the results. Finally, they will know which information needs to be included in their publications. Includes checklists for planning projects, creating input files, analyzing output files, and for troubleshooting, as well as exercises and tests throughout.

Author Biography

Read more

Table of Contents

Read more

Write a Review