Modeling Coronene Nanostructures: Analytical Potential, Stable Configurations and Ab Initio Energies
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.7b03691
Abstract: Coronene is one of the basic polycyclic aromatic hydrocarbons (PAHs) used to test the reliabilty of a multidimensional potential energy surface (PES) and to assess its influence on the formation dynamics of PAH clusters with… read more here.
Keywords: potential stable; analytical potential; coronene nanostructures; nanostructures analytical ... See more keywords