Organic Solar Cells

Electronic and vibronic properties of a discotic liquid-crystal and its charge transfer complex

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Direct View on Nanoionic Proton Mobility

Direct Determination of the Base-Pair Force Constant of DNA from the Acoustic Phonon Dispersion of the Double Helix

Conformation, Defects, and Dynamics of a Discotic Liquid Crystal and Their Influence on Charge Transport

Density functional calculations of potential energy surface and charge transfer integrals in molecular triphenylene derivative HAT6

Molecular Modelling of Ground- and Excited-States Vibrations in Organic Conducting Devices: Hexakis(n-hexyloxy)triphenylene (HAT6) as Case Study

A compact model system for electron-phonon calculations in discotic materials

Phonon driven proton transfer in crystals with short strong hydrogen bonds

A compact model system for electronphonon calculations in discotic materials

Neutron inelastic scattering and molecular modelling

How phonons govern the Behavior of short, strong hydrogen bonds in ureaphosphoric acid

Intermolecular interactions in solid benzene

Combining simulations and neutron scattering experiments: from models to systems of biological and technological interest

Structural information on ball milled magnesium hydride from vibrational spectroscopy and ab-initio calculations

Studies on the microstructural behaviour of MgH2 using neutron, positron and electron analysis

The vibrational spectrum of magnesium hydride from inelastic neutron scattering and density funcional theory

The vibrational spectrum of magnesium hydride from inelastic neutron scattering and Density Functional Theory

L'effet tunnel et les protéines