Computation of the Forgotten Topological Index and Co-Index for Carbon Base Nanomaterial
Özge Çolakoğlu Havare, Ali Havare
Abstract
Özge Çolakoğlu Havare, Ali Havare
Abstract
Molecular topological indices are numerical descriptor of molecular structure obtained via molecular graph G. The forgotten topological index F(G) is a vertex degree based topological index and it can be expressed with F(G)=∑d(v)3=∑d(u)2+d(v)2, where d(u) denotes the degree of u. The forgotten co-index Co-F(G) is defined as the sum of squares of a graph’s vertex degrees which is not adjacent. In this study, the F(G) and Co-F(G) index of HAC5C7, HAC5C6C7, linear [n]-phenylenes and cyclic phenylenes nanostructures are computed for possible works in the properties of molecules such as structure–property relationship. In addition, polynomials of the forgotten index and co-index are found for these nanostructures.
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Molecular topological indices are numerical descriptor of molecular structure obtained via molecular graph G. The forgotten topological index F(G) is a vertex degree based topological index and it can be expressed with F(G)=∑d(v)3=∑d(u)2+d(v)2, where d(u) denotes the degree of u. The forgotten co-index Co-F(G) is defined as the sum of squares of a graph’s vertex degrees which is not adjacent. In this study, the F(G) and Co-F(G) index of HAC5C7, HAC5C6C7, linear [n]-phenylenes and cyclic phenylenes nanostructures are computed for possible works in the properties of molecules such as structure–property relationship. In addition, polynomials of the forgotten index and co-index are found for these nanostructures.
Key concepts: Molecular graph, Topological index, Vertex (graph theory), Index (typography), Chemistry, Graph, Topology (electrical circuits), Combinatorics