hotFCHT

H.-C. Jankowiak, Joonsuk Huh and R. Berger.

hotFCHT is a general purpose program for calculating Franck-Condon and Herzberg-Teller integrals. The new release is planned for May 31, 2012.

[hotFCHT]

Features

Spectroscopy

Photophysical/Photochemical Properties

References

  1. H.-C. Jankowiak, J. L. Stuber and Robert Berger, Vibronic transitions in large molecular systems: Rigorous pre-screening conditions for Franck-Condon factors, J. Chem. Phys., 2007, 127, 234101.
  2. R. Berger, C. Fischer and M. Klessinger, Calculation of the vibronic fine structure in electronic spectra at higher temperatures. 1. Benzene and pyrazine, J. Phys. Chem. A, 1998, 102, 7157-7167.
  3. R. Berger and M. Klessinger, Algorithms for exact counting of transition energy levels at different temperatures, J. Comput. Chem., 1997, 18, 1312-1319.
© 2008 R. Berger
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