Andreas B. J. Parusel

University of Vienna — Austria

Chemistry · Physical Sciences

19h-index1.4kcitations36works0.02yr avg
OpenAlex↗Google Scholar↗Lab page↗

Accepting Students?

No reports yet. Know if this professor is taking students?

Research Topics

Photochemistry and Electron Transfer Studies(27), Porphyrin and Phthalocyanine Chemistry(11), Spectroscopy and Quantum Chemical Studies(10), Photosynthetic Processes and Mechanisms(8), Molecular Junctions and Nanostructures(5)

Publications35 total

A Comparative Theoretical Study on DMABN:  Significance of Excited State Optimized Geometries and Direct Comparison of Methodologies
The Journal of Physical Chemistry A·2002· 67 cited
Spectroscopic and Theoretical Studies of 6-<i>N</i>,<i>N</i>-Dimethyladenine<sup>†</sup>
The Journal of Physical Chemistry A·2002· 16 cited
Absence of Dual Fluorescence in Cyano Isomers and Di-Cyano Derivatives Related to N,N-Dimethyl-4-Aminobenzonitril: A DFT/MRCI Study
Zeitschrift für Physikalische Chemie·2002· 7 cited
A semiempirical study of the optimized ground and excited state potential energy surfaces of retinal and its protonated Schiff base
Journal of Photochemistry and Photobiology B Biology·2001· 4 cited
Nonlinear optics. A semiempirical study of organic chromophores
Journal of Molecular Structure THEOCHEM·2001· 27 cited
Excited state intramolecular charge transfer in N,N-heterocyclic-4-aminobenzonitriles: a DFT study
Chemical Physics Letters·2001· 25 cited
DFT/MRCI calculations on the excited states of porphyrin, hydroporphyrins, tetrazaporphyrins and metalloporphyrins
Journal of Porphyrins and Phthalocyanines·2001· 107 cited
Influence of the alkyl chain length on the excited‐state properties of 4‐dialkyl‐benzonitriles. A theoretical DFT/MRCI study
International Journal of Quantum Chemistry·2001· 9 cited
Do Nonplanar Porphyrins Have Red-Shifted Electronic Spectra? A DFT/SCI Study and Reinvestigation of a Recent Proposal
Journal of the American Chemical Society·2000· 140 cited
A Theoretical Study of the Excited States of Chlorophyll<i> a</i> and Pheophytin <i>a</i>
The Journal of Physical Chemistry B·2000· 98 cited
A semiempirical study for the ground and excited states of free-base and zinc porphyrin–fullerene dyads
Journal of Photochemistry and Photobiology B Biology·2000· 11 cited
Electronic Structure of Gallium, Copper, and Nickel Complexes of Corrole. High-Valent Transition Metal Centers versus Noninnocent Ligands
Journal of the American Chemical Society·2000· 191 cited
Enzyme-mimetic model compounds: conformational analysis and far-IR study of Cu(TAAB)2+
Journal of Inorganic Biochemistry·2000· 5 cited
Density Functional Theory Based Configuration Interaction Calculations on the Electronic Spectra of Free-Base Porphyrin, Chlorin, Bacteriochlorin, and <i>cis</i>- and <i>trans</i>-Isobacteriochlorin
The Journal of Physical Chemistry A·2000· 59 cited
A DFT/MRCI study on the excited state charge transfer states of N-pyrrolobenzene, N-pyrrolobenzonitrile and 4-N,N-dimethylaminobenzonitrile
Physical Chemistry Chemical Physics·2000· 77 cited
Internal Conversion with 3,5-Dimethyl-4-(methylamino)benzonitrile in Alkane Solvents
Zeitschrift für Physikalische Chemie·2000· 14 cited
CCDC 115670: Experimental Crystal Structure Determination
The Cambridge Structural Database·2000Open Access
Acid–base properties of bis-pyrazolopyridine derivatives in nonaqueous solutions
Journal of Photochemistry and Photobiology A Chemistry·1999· 17 cited
Synthesis, Spectroscopy, and Semiempirical Study of a Novel Porphyrin-Flavin Dyad
Chemistry - A European Journal·1999· 19 cited
Synthesis, Spectroscopy, and Semiempirical Study of a Novel Porphyrin–Flavin Dyad
Chemistry - A European Journal·1999
page 1 of 2Next →

Frequent Co-authors

Gottfried Köhler(18), Rudolf Schamschule(9), Karl Rechthaler(5), Krystyna Rotkiewicz(5), Stefan Grimme(4), D. Piorun(4), Abhik Ghosh(3), Dominik Hermann(3), Κ. Polborn(3), R. Gompper(3), Susanne Stark(3), Gottfried Grabner(3), Tebikie Wondimagegn(2), Wolfgang Rettig(2), F. W. Schneider(2), Anne Christina Schindler(2), Wiesław Nowak(1), Wibke Sudholt(1), Marcel Nooijen(1), Rudi Hutterer(1)