Grimme, Stefan

Stefan Grimme, Calculation of the Electronic Spectra of Large Molecules. 

Acknowledgments T.M. thanks the Alexander von Humboldt-Stiftung for the fellowship. We thank Prof. Stefan Grimme at Universitat Munster for his support at the very beginning of the calculations of CD spectra and fruitful discussion on the theoretical aspects. T.M. offers his thanks for the financial supports of this work by a Grant-in-Aid for Scientific Research (No. 21750044) from the Ministry of Education, Culture, Sports, Science and Technology (MEXT), Japan, Mitsubishi Chemical Corporation Fund, and the Sumitomo Foundation. Y.I. offers his thanks for the support of this work by a Grant-in-Aid for Scientific Research (A) from JSPS (No. 21245011). 

Martin Korth, Roland Frdhlich, Stefan Grimme... 

Stefan Grimme, Calculation of the Electronic Spectra of Largo Molecules. Raymond Kapral, Simulating Chemic al Wavt and Patterns. 

Stephan Fritzsche Walter Greiner Stefan Grimme Eberhard K. U. Gross Bemd Hess Jurgen Hinze Martin Kaupp Dietmar Kolb Jens Volker Kratz Jurgen Kiibler... 

Among the approaches discussed here, the most simple and straightforward and thus the most practical approach is that followed by Stefan Grimme [54, 55]. Grimme defined the dispersion corrected total energy Emf-d as... 

Stefan Grimme, Theoretische Organische Chemie, Organisch-Chemisches Institut der Universitat Munster, Correnstrasse 40, D-48149 Munster, Germany. (Electronic mail grimmes uni-muenster.de)... 

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