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Dr. Marc Dierksen back |
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Dr. Marc Dierksen Ph.D.: Calculations of vibronic structure of electronic spectra for large molecules (November 30 th, 2006) Diploma / M.Sc degree: Westfälische Wilhelms-Universität, Münster, Germany (May 2003) Homepage: http://www.uni-muenster.de./Chemie/OC/research/grimme/dierksen.html eMail: dierksen@uni-muenster.de Publications M. Dierksen, S. Grimme A theoretical study of the chiroptical properties of molecules with isotopically engendered chirality J. Chem. Phys. , 124 (2006), 174301. M. Dierksen, S. Grimme An efficient approach for the calculation of Franck-Condon integrals of large molecules J. Chem. Phys. , 122 (2005), 244101-244101-9. M. Dierksen, S. Grimme Density Functional Calculations of the Vibronic Structure of Electronic Absorption Spectra J. Chem. Phys. , 120 (2004), 3544-3554. M. Dierksen, S. Grimme The Vibronic Structure of Electronic Absorption Spectra of Large Molecules: A Time-Dependent Density Functional Study on the Influence of "Exact" Hartree-Fock Exchange J. Phys. Chem. , 108 (2004), 10225-10237. |
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