Chapter 28. Basis Set Customization

  1. David C. Young

Published Online: 25 APR 2002

DOI: 10.1002/0471220655.ch28

Book Title

Computational Chemistry: A Practical Guide for Applying Techniques to Real World Problems

Computational Chemistry: A Practical Guide for Applying Techniques to Real World Problems

Additional Information

How to Cite

Young, D. C. (2002) Basis Set Customization, in Computational Chemistry: A Practical Guide for Applying Techniques to Real World Problems, John Wiley & Sons, Inc., New York, USA. doi: 10.1002/0471220655.ch28

Author Information

  1. Cytoclonal Pharmaceutics Inc.

Publication History

  1. Published Online: 25 APR 2002
  2. Published Print: 21 FEB 2001

ISBN Information

Print ISBN: 9780471333685

Online ISBN: 9780471220657

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CHAPTER TOOLS

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Keywords:

  • BSSE;
  • polarization;
  • diffuse functions

Summary

Chapter 28 is devoted to basis set customization. Precautions and procedures for customizing basis sets are presented. A discussion of basis set superposition error is included.

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