let g be a simple graph with vertex set v(g) {v1,v2 ,...vn} . for every vertex i v , ( ) i  vrepresents the degree of vertex i v . the h-th order of randić index, h r is defined as the sumof terms1 2 11( ), ( )... ( ) i i ih  v  v  vover all paths of length h contained (as sub graphs) in g . inthis paper , some bounds for higher randić index and a method for computing the higherrandic ind...

Two stage self-assembly of novel coronene monoimide (CMI) based gels that results in resurfacing of monomer emission in the aggregated state is reported. This process is attributed to a frustrated head-head dipolar assembly forced by hydrogen bonding.

The use of the long-lived fluorescence probe coronene (mean value of tau(FL) approximately 200 ns) is described for investigating submicrosecond lipid dynamics in DPPC model bilayer systems occurring below the lipid phase transition. Time-resolved fluorescence emission anisotropy decay profiles, measures as a function of increasing temperature toward the lipid-phase transition temperature (T(C)...

Global optimization reveals that aggregation is enhanced for coronene substituted with carboxylic and amine groups, which due to the influence of weak hydrogen bonds stronger electrostatic contributions.

Ultraviolet photolysis of various coronene-ice mixtures at low temperature and pressure caused the addition of amino (”NH2), methyl (”CH3), methoxy (”OCH3), cyano/isocyano (”CN, ”NC), and acid (”COOH) functional groups to the polycyclic aromatic hydrocarbon (PAH) coronene (C24H12), in addition to previously reported alcohol (”OH) and ketone (>C»O) formation. This work represents the first exper...

The large polycyclic aromatic hydrocarbon molecules coronene, benzo[GHI]perylene, and anthracene have been ionized with femtosecond laser pulses at low laser intensities and the ionization process studied with velocity map imaging spectroscopy, supplemented with ion yield measurements. The electron spectra of coronene and benzo[GHI]perylene are structureless. Based on fluence and pulse duration...

Clusters of polycyclic aromatic hydrocarbons (PAHs) are essential components of soot and may concentrate a significant fraction of carbon matter in the interstellar medium. In this contribution, coarse-grained potentials are parameterized using all-atom reference data to model PAH molecules, such as coronene (C24H12) or circumcoronene (C54H18), and their aggregates. Low-energy structures of pur...

We have carefully investigated the structural and electronic properties of coronene and some of its fluorinated and chlorinated derivatives, including full periphery substitution, as well as the preferred orientation of the non-covalent dimer structures subsequently formed. We have paid particular attention to a set of methodological details, to first obtain single-molecule magnitudes as accura...

The use of a coronene guest template directs the formation of a 2D Kagomé network in preference to alternative close packed and parallel hydrogen-bonded structures of tetracarboxylic acid tectons self-assembled from solution on a graphite surface.

In this paper, we systematically studied the effects of coronene as nucleation seeds for graphene synthesis at low temperatures by chemical vapor deposition. Naphthalene was used as a solid carbon source which is capable of producing graphene at temperatures down to 300 °C. The experimental results showed clear evidence that coronene seeds work as preferred nucleation sites, through which the n...