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Publications 2005 - 2009

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Publications 2009
63Michael Schmitt, Lars Biemann, W. Leo Meerts, Karl Kleinermanns:
Analysis of the FTIR spectrum of pyrazine using evolutionary algorithms.
J. Mol. Spectros. 257 (2009) 74
62Ivo Kalkman, Christian Brand, Thi-Bao Chau Vu, W. Leo Meerts, Yuriy N. Svartsov, Otto Dopfer, Xin Tong, Klaus Müller Dethlefs, Stefan Grimme, Michael Schmitt:
The structure of phenol-Arn (n=1, 2) clusters in their S0 and S1 states.
J. Chem. Phys. 130 (2009) 224303
61Ivo Kalkman, Thi-Bao Chau Vu, Michael Schmitt, W. Leo Meerts:
Structure and internal rotation in the S0 and S1 states of o-toluidine studied by high resolution UV spectroscopy.
Phys. Chem. Chem. Phys. 11 (2009) 4311
60Thi Bao Chau Vu, Ivo Kalkman, W. Leo Meerts, Christian Brand, Yuriy N. Svartsov, Sascha Wiedemann, Rainer Weinkauf, Michael Schmitt:
The conformational landscape of 5-methoxytryptamine studied by rotationally resolved fluorescence spectroscopy and resonant ionization spectroscopy.
Phys. Chem. Chem. Phys. 11 (2009) 2433
59Marcel Böhm, Jörg Tatchen, Daniel Krügler, Karl Kleinermanns, Michael G. D. Nix, Tracy A. LeGreve, Timothy S. Zwier, Michael Schmitt:
High-resolution and Dispersed Fluorescence Examination of Vibronic bands of Tryptamine: Spectroscopic signatures for La/Lb mixing near a conical intersection.
J. Phys. Chem. A 113 (2009) 2456
58Marcel Böhm, Robert Brause, Christoph Jacoby, Michael Schmitt:
Conformational Relaxation Paths in Tryptamine.
J. Phys. Chem. A 113 (2009) 448
Publications 2008
57Michael Motsch, Markus Schenk, Martin Zeppenfeld, Michael Schmitt, W. Leo Meerts, Pepijn W.H. Pinkse, Gerhard Rempe:
Spectroscopy of the  Ã1A21A1 transition of formaldehyde in the 30140–30790 cm-1 range: The 210 430 and 220 410 rovibrational bands.
J. Mol. Spectrosc. 252 (2008) 25
56Ivo Kalkman, Thi Bao Chau Vu, Michael Schmitt, W. Leo Meerts:
Tunneling splittings in the S0 and S1 states of the benzoic acid dimer determined by high resolution UV spectroscopy.
ChemPhysChem. 9 (2008) 1788
55Thi Bao Chau Vu, Ivo Kalkman, W. Leo Meerts, Yuriy N. Svartsov, Christoph Jacoby, Michael Schmitt:
Rotationally resolved electronic spectroscopy of water clusters of 7-azaindole.
J. Chem. Phys. 128 (2008) 214311
54Yuriy N. Svartsov, Michael Schmitt:
Electronically excited states of water clusters of 7-azaindole: Structures, relative energies, and electronic nature of the excited states.
J. Chem. Phys. 128 (2008) 214310
Publications 2007
53Brause, R., Schmitt M., Kleinermanns, K.:
Improved Determination of Structural Changes of 2-Pyridone-(H2O)1 upon Electronic Excitation.
J. Phys. Chem. A. 111 (2007) 3287
52Robert Brause, Monika Santa, Michael Schmitt, Karl Kleinermanns:
Determination of the Geometry Change of the Phenol Dimer upon Electronic Excitation.
ChemPhysChem 8 (2007) 1394
Publications 2006
51Böhm, M., Ratzer, C., Schmitt, M.:
The structure of p-chlorophenol and barrier to internal -OH rotation in the S1-state.
J. Mol. Struc. 800 (2006) 55
50Lee, Y., Kim, B., Schmitt, M., Kleinermanns, K.:
Observation of Ultraviolet Rotational Band Contours of the DNA Base Adenine: Determination of the Transition Moment.
J. Phys. Chem. A 110 (2006) 11819
49Schmitt, M., Brause, R., Marian, C., Salzmann, S., Meerts, W. L.:
Electronically excited states of tryptamine and its microhydrated complex.
J. Chem. Phys. 125 (2006) 124309
48Schmitt, M., Feng, K., Böhm, M., Kleinermanns, K.:
Low frequency backbone vibrations of individual conformational isomers: tryptamine.
J. Chem. Phys. 125 (2006) 144303
47Meerts, W. L. und Schmitt, M.:
Application of Genetic Algorithms in automated assignments of high resolution spectra.
Int. Rev. Phys. Chem. 25 (2006) 353
46Schmitt, M., Böhm, M., Ratzer, C., Krügler, D., Kleinermanns, K., Kalkman, I., Berden, G., Meerts, W. L.:
Determining the intermolecular structure in the S0 and S1 states of the phenol dimer by rotationally resolved electronic spectroscopy.
ChemPhysChem 7 (2006) 1241
45Schmitt, M., Böhm, M., Ratzer, C., Siegert, S., van Beek, M., Meerts, W. L.:
Electronic excitation in the benzonitrile dimer: The intermolecular structure in the S0 and S1 state determined by rotationally resolved electronic spectroscopy.
J. Mol. Struct. 795 (2006) 234
44Jacoby, C., Böhm, M., Vu, C., Ratzer, C., Schmitt, M.:
Probing the acidity of p-substituted phenols in the excited state: electronic spectroscopy of the p-cyanophenol-water cluster.
ChemPhysChem 7 (2006) 448
43Schmitt, M., Krügler, D., Böhm, M., Ratzer, C., Bednarska, V., Kalkman, I., Meerts, W. L.:
A genetic algorithm based determination of the ground and excited 1Lb state structure and the orientation of the transition dipole moment of benzimidazole.
Phys. Chem. Chem. Phys. 8 (2006) 228
42Meerts, W. L. and Schmitt, M.:
A new automated assign and analysing method for high resolution rotational resolved spectra using Genetic Algorithms.
Phys. Scripta 73 (2006) C47
Publications 2005
41Brause, R., Krügler, D., Schmitt, M., Kleinermanns, K., Nakajima, A., Miller, T. A.:
Determination of the excited state structure of 7-azaindole water cluster using a Franck-Condon analysis.
J. Chem. Phys. 123 (2005) 224311
40Myszkiewicz, G., Meerts, W. L., Ratzer, C., Schmitt, M.:
Structure Determination of Resorcinol Rotamers by High-Resolution UV Spectroscopy.
ChemPhysChem 6 (2005) 2129
39Schmitt, M., Böhm, M., Ratzer, C., Vu, C., Kalkman, I., Meerts, W. L.:
Structural selection by microsolvation: conformational locking of tryptamine.
J. Am. Chem. Soc. 127 (2005) 10356
38Myszkiewicz, G., Meerts, W. L., Ratzer, C., Schmitt, M.:
The structure of 4-methylphenol and its water cluster revealed by rotationally resolved UV-spectroscopy using a genetic algorithm approach.
J. Chem. Phys. 123 (2005) 044304
37Myszkiewicz, G., Meerts, W. L., Ratzer, C., Schmitt, M.:
Rotational isomers of hydroxy deuterated o- and m-cresols studied by ultraviolet high resolution experiments.
Phys. Chem. Chem. Phys. 7 (2005) 2142
36Schmitt, M., Ratzer, C., Jacoby, C., Meerts, W. L.:
Structure and barrier to internal rotation of 4-methylstyrene in the S0- and S1-state.
J. Mol. Struc. 742 (2005) 123
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