The cluster formation of water in organic solvents – running

Water has been the main topic of scientific research due to its vital role. In liquid phase water molecules are aggregated by Hydrogen bonds forming different size clusters.

Our aim is to investigate the structure, behaviour of water in different organic solvents with classical molecular dynamics simulations. The size of water clusters probably influence such basic properties of water as acidity or reactivity.

Project owner:
Szabó Gergő (Szervetlen és Analitikai Kémia Tanszék)
Szervetlen és Analitikai Kémia Tanszék (VBK-IAACHEM)