Related papers: Some open mathematical problems on fullerenes
We study a class of complex polynomial equations on a finite graph with a view to understanding how holistic phenomena emerge from combinatorial structure. Particular solutions arise from orthogonal projections of regular polytopes,…
The electronic spectrum of sheets of graphite (plane honeycomb lattice) folded into regular polihedra is studied. A continuum limit valid for sufficiently large molecules and based on a tight binding approximation is derived. It is found…
A perfect star packing in a graph G is a spanning subgraph of G whose every component is isomorphic to the star graph $K_{1,3}$. A perfect star packing of a fullerene graph G is of type P0 if all the centers of stars lie on hexagons of G.…
We present an infinite series of operations on fullerenes generalizing the Endo-Kroto operation, such that each combinatorial fullerene is obtained from the dodecahedron by a sequence of such operations. We prove that these operations are…
We consider the low-energy electronic properties of graphene cones in the presence of a global Fries-Kekul\'e Peierls distortion. Such cones occur in fullerenes as the geometric response to the disclination associated with pentagon rings.…
While crystalline two-dimensional materials have become an experimental reality during the past few years, an amorphous 2-D material has not been reported before. Here, using electron irradiation we create an sp2-hybridized one-atom-thick…
A full-homomorphism between a pair of graphs is a vertex mapping that preserves adjacencies and non-adjacencies. For a fixed graph $H$, a full $H$-colouring is a full-homomorphism of $G$ to $H$. A minimal $H$-obstruction is a graph that…
In this paper we analyze nonlinear dynamics of the fullerene molecule. We prove the existence of global branches of periodic solutions emerging from an icosahedral equilibrium (nonlinear normal modes). We also determine the symmetric…
Many applications, ranging from natural to social sciences, rely on graphlet analysis for the intuitive and meaningful characterization of networks employing micro-level structures as building blocks. However, it has not been thoroughly…
Call {\em i-hedrite} any 4-valent n-vertex plane graph, whose faces are 2-, 3- and 4-gons only and $p_2+p_3=i$. The edges of an i-hedrite, as of any Eulerian plane graph, are partitioned by its {\em central circuits}, i.e. those, which are…
We discuss the influence of a single or double fullerenes shell upon photoionization and vacancy decay of an atom, stuffed inside the fullerenes construction. The main manifestations of this influence are additional structures in the…
Bulk amorphous materials have been studied extensively and are widely used, yet their atomic arrangement remains an open issue. Although they are generally believed to be Zachariasen continuous random networks, recent experimental evidence…
Assembling clusters on surfaces has emerged as a novel way to grow thin films with targeted properties. In particular, it has been proposed from experimental findings that fullerenes deposited on surfaces could give rise to thin films…
We introduce a new model of indeterminacy in graphs: instead of specifying all the edges of the graph, the input contains all triples of vertices that form a connected subgraph. In general, different (labelled) graphs may have the same set…
Fullerenes are lowest energy structures for gas phase all-carbon particles for a range of sizes, but graphite remains the lowest energy allotrope of bulk carbon. This implies that the lowest energy structure changes nature from fullerenes…
The spectral theory of quantum graphs is related via an exact trace formula with the spectrum of the lengths of periodic orbits (cycles) on the graphs. The latter is a degenerate spectrum, and understanding its structure (i.e.,finding out…
The stability of Ne@C$_{60}$ and He@C$_{60}$ is discussed in the context of a spherical model where the carbon atoms are smeared out into a uniform shell. The electronic properties of the sixty $\pi$ electrons together with those of the…
The localization of the valence electron of $H$, $Li$ and $Na$ atoms enclosed by three different fullerene molecules is studied. The structure of the fullerene molecules is used to calculate the equilibrium position of the endohedrally atom…
Topology is a central concept of mathematics, which allows us to distinguish two isolated rings with linked ones. In material science, researchers discovered topologically different carbon allotropes in a form of a cage, a tube, and a…
A pseudo-Jahn-Teller model describing central atom distortions is proposed for endohedral fullerenes of the form A@C$_{60}$ where A is either a rare gas or a metal atom. A critical (dimensionless) coupling $g_c$ is found, below which the…