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Publications 2000 - 2004

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Publications 2004

Jacoby, C. and Schmitt, M.:

Torsional barriers in aromatic molecular clusters as probe of the electronic properties of the chromophore.

Chem. Phys. Chem. 5 (2004) 1686


Schmitt, M., Ratzer, C., Kleinermanns, K. and Meerts, W. L.:

Determination of the structure of 7-azaindole in the electronic ground and excited state using high resolution ultra-violet spectroscopy and an automated assignment based on a genetic algorithm.

Mol. Phys. 102 (2004) 1605


Brause, R., Schmitt, M., Spangenberg, D. and Kleinermanns, K.:

Determination of the excited state structure of 7-azaindole using a Franck–Condon analysis.

Mol. Phys. 102 (2004) 1615


Meerts, W. L., Schmitt, M. and Groenenboom, G.:

New applications of the Genetic Algorithm for the interpretation of High Resolution Spectra.

Can. J. Chem. 82 (2004) 804


Schmitt, M., Ratzer., C. and Meerts, W. L.:

The structure of the phenol-nitrogen cluster. A joint experimental and ab initio study.

J. Chem. Phys. 120 (2004) 2752

Publication 2003

Westphal, A., Jacoby, C., Ratzer, C., Reichelt, A. and Schmitt, M.:

Determination of the intermolecular geometry of the phenol-methanol cluster.

Phys. Chem. Chem. Phys. 5 (2003) 4114


Ratzer, C., Nispel, M. und Schmitt, M.:

Structure of 4-fluorophenol and barrier to internal -OH torsion in the S1-state.

Phys. Chem. Chem. Phys. 5 (2003) 812
Publications 2002

Küpper, J., Schmitt, M. and Kleinermanns, K.:

The Rotationally Resolved Electronic Spectrum of p-Cyanophenol.

Phys. Chem. Chem. Phys. 4 (2002) 4634


Ratzer, C., Küpper, J., Spangenberg, D. and Schmitt, M.:

The structure of phenol in the S1-state determined by high resolution UV-spectroscopy.

Chem. Phys. 283 (2002) 153


Plützer, C., Jacoby, C. and Schmitt, M.:

Internal rotation and intermolecular vibrations of the phenol-methanol cluster: A Comparison of Spectroscopic Results and Ab Initio Theory.

J. Phys. Chem. A 106 (2002) 3998

Publications 2001

Schmitt, M., Plützer, C. and Kleinermanns, K.:

Determination of the structures of benzotriazole(H2O)1,2 clusters by IR-UV spectroscopy and ab initio theory.

Phys. Chem. Chem. Phys. 3 (2001) 4218


Küpper, J., Westphal, A. and Schmitt, M.:

The structure of the binary phenol-methanol cluster: A comparison of experiment and ab initio theory.

Chem. Phys. 263  (2001) 41

Publications 2000

Schmitt, M., Küpper, J., Spangenberg, D. and Westphal, A.:

Determination of the structures and barriers to hindered internal rotation of the phenol-methanol cluster in the S0 and S1 state.

Chem. Phys. 254 (2000) 349


Schmitt, M., Jacoby, C., Gerhards, M., Unterberg, C., Roth, W. and  Kleinermanns, K.:

Structures and vibrations of phenol(NH3)2-4 clusters.

J. Chem. Phys. 113 (2000) 2995


Jacoby, C., Roth, W. and Schmitt, M.:

A comparison of intermolecular  vibrations and tautomerism in benzimidazole, benzotriazole and their binary water clusters.

Appl. Phys. B 71 (2000) 643

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