Artificial Neural Networks (NN) are already heavily involved in methods and applications for
frequent tasks in the field of computational chemistry such as representation of potential …

We discuss how Coulomb explosion imaging (CEI), triggered by intense femtosecond laser
pulses and combined with laser-induced alignment and covariance analysis of the angular …

Following structural dynamics in real time is a fundamental goal towards a better
understanding of chemical reactions. Recording snapshots of individual molecules with …

Atomic nuclei are self-organized, many-body quantum systems bound by strong nuclear
forces within femtometre-scale space. These complex systems manifest a variety of shapes …

Amino acids are among the building blocks of life, forming peptides and proteins, and have
been carefully 'selected'to prevent harmful reactions caused by light. To prevent …

Coulomb explosion imaging (CEI) with x-ray free electron lasers has recently been shown to
be a powerful method for obtaining detailed structural information of gas-phase planar ring …

Directly imaging structural dynamics involving hydrogen atoms by ultrafast diffraction
methods is complicated by their low scattering cross sections. Here we demonstrate that …

We extend covariance velocity map ion imaging to four particles, establishing cumulant
map** and allowing for measurements that provide insights usually associated with …

We tested the effect of different ways of sampling the initial conditions in surface hop**
simulations, with a focus on the initial energy distributions and on the treatment of the zero …

Conformational isomers (conformers) of molecules play a decisive role in biology and
organic chemistry. However, experimental methods for investigating chemical reaction …