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Computational quantum chemistry II : The group theory calculator /

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"...describes the group theory that the authors have developed in the past twenty-five years and illustrates how this approach, known as the 'Spherical Shell' method, can be applied to solve a variety of problems that benefit from a group theory analysis"--Publisher's web pa...

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Bibliographic Details
Main Author: Quinn, Charles M.
Other Authors: Fowler, P. W., Redmond, David B.
Format: Book
Language:English
Published: San Diego, Calif. : Academic Press, [2005]
Subjects:
Quantum chemistry > Data processing.
Combinatorial group theory.
Table of Contents:
  • 1. Operating instructions for the Group Theory Calculator
  • 2. Geometry, orbits and decorations
  • 3. Decorations of orbits using local functions...
  • 4. Symmetrical powers and their applications
  • Appendix 1. The icosahedral harmonics
  • Appendix 2. Quantum chemistry on an EXCEL spreadsheet
  • Appendix 3. Sample input files for the ApianusII.exe and FunctionalPlot.exe programmes on the CDROM
  • Bibliographys
  • Index.