Computational Study of Hydrogen Bonded Systems - Bok av Jan Kazimirski - Häftad
Water is one of the most interesting chemical systems to study. Investigation of water clusters can help to understand unique properties of condensed phase and particulate H2O. One of the main problems encountered while studying these systems is the global minimum problem. The potential energy landscape of water clusters becomes more and more complicated with growing number of water molecules. In this work we use a combined approach to search of minima of water clusters. It is based on a combination..
