Dr. Scient, University of Copenhagen
Ph.D., Theoretical Chemistry, Aarhus University
We use scientific computing methods to investigate the dynamics and control of molecular perturbations, solvent effects, chemical reactions in homogeneous and heterogeneous environments. Presently, we target areas as biophotonics (design of optimal two-photon sensitizers), photonics (structure-property relationships for potential optical data and computer components), nanoscience (linear and nonlinear optical properties of carbon nanotubes), development of new models for homogeneous and heterogeneous solvation along with the calculation of linear and non-linear molecular properties of solutes and development of new models to describe interactions between nanosized particles and organic molecules along with the calculation of kinetic parameters used in macroscopic modelling in nanoscience and atmospheric chemistry.We use scientific computing methods to investigate the dynamics and control of molecular perturbations, solvent effects, chemical reactions in homogeneous and heterogeneous environments. Presently, we target areas as biophotonics (design of optimal two-photon sensitizers), photonics (structure-property relationships for potential optical data and computer components), nanoscience (linear and nonlinear optical properties of carbon nanotubes), development of new models for homogeneous and heterogeneous solvation along with the calculation of linear and non-linear molecular properties of solutes and development of new models to describe interactions between nanosized particles and organic molecules along with the calculation of kinetic parameters used in macroscopic modelling in nanoscience and atmospheric chemistry.We use scientific computing methods to investigate the dynamics and control of molecular perturbations, solvent effects, chemical reactions in homogeneous and heterogeneous environments. Presently, we target areas as biophotonics (design of optimal two-photon sensitizers), photonics (structure-property relationships for potential optical data and computer components), nanoscience (linear and nonlinear optical properties of carbon nanotubes), development of new models for homogeneous and heterogeneous solvation along with the calculation of linear and non-linear molecular properties of solutes and development of new models to describe interactions between nanosized particles and organic molecules along with the calculation of kinetic parameters used in macroscopic modelling in nanoscience and atmospheric chemistry.
In the period 2004-2009 published 66 articles out of a total of more than 200 reviewed articles along with 3 books on molecular dynamics and chemical kinetics and two popular reports on scientific computing. My first publication appeared in 1987, I have more than 4100 citations and my H-index is 34.