A QUANTUM-CHEMICAL INVESTIGATION OF THE INTERACTION OF ORGANIC-MOLECULES AND POLYMERS WITH GRAPHITE - COMPARISON WITH THE STM IMAGING OF ORGANIC ADSORBATES
G. Lambin et al., A QUANTUM-CHEMICAL INVESTIGATION OF THE INTERACTION OF ORGANIC-MOLECULES AND POLYMERS WITH GRAPHITE - COMPARISON WITH THE STM IMAGING OF ORGANIC ADSORBATES, Synthetic metals, 57(2-3), 1993, pp. 4365-4370
We investigate the adsorption of organic molecules and polymers onto t
he graphite surface with a quantum chemical approach. For this purpose
, we study the geometry, the energetics and the electronic structure i
n a series of model systems, consisting of small molecules (CH4, H2O,
H2S, CF4, benzene) interacting with one benzene molecule. Our results
are interpreted in the framework of the STM imaging of organic molecul
es and polymers on graphite substrates.