Computational quantum chemistry an interactive guide to basis set theory
This textbook is an interactive learning tool in which the power of EXCEL spreadsheet technology is applied to make plain the fundamentals of basis set theory in atomic and molecular orbital calculations. Spreadsheet calculations are provided on the accompanying CD-ROM.
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| Format: | eBook |
| Language: | English |
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San Diego, Calif.
Academic Press
©2002, 2002
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| Collection: | Elsevier ScienceDirect eBooks - Collection details see MPG.ReNa |
Table of Contents:
- Includes bibliographical references (pages 229-230) and index
- numerical solutions
- The helium atom and the self-consistent field
- One- and two-electron diatoms