On construction of upper and lower bounds for the HOMO-LUMO spectral gap
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Publication:2273100
Abstract: In this paper we study spectral properties of graphs which are constructed from two given invertible graphs by bridging them over a bipartite graph. We analyze the so-called HOMO-LUMO spectral gap which is the difference between the smallest positive and largest negative eigenvalue of the adjacency matrix of a graph. We investigate its dependence on the bridging bipartite graph and we construct a mixed integer semidefinite program for maximization of the HOMO-LUMO gap with respect to the bridging bipartite graph. We also derive upper and lower bounds for the optimal HOMO-LUMO spectral graph by means of semidefinite relaxation techniques. Several computational examples are also presented in this paper.
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Cites work
- scientific article; zbMATH DE number 3717357 (Why is no real title available?)
- scientific article; zbMATH DE number 3001568 (Why is no real title available?)
- scientific article; zbMATH DE number 2107836 (Why is no real title available?)
- A Lagrangian-DNN relaxation: a fast method for computing tight lower bounds for a class of quadratic optimization problems
- A note on inverses of labeled graphs
- Acyclic molecules with greatest HOMO-LUMO separation
- Extremal values of matching energies of one class of graphs
- HL-index of a graph
- HOMO-LUMO maps for chemical graphs
- Inverses of trees
- Median eigenvalues and the HOMO-LUMO index of graphs
- Median eigenvalues of bipartite planar graphs
- Nonlinear programming, theory and algorithms
- Note on the HOMO-LUMO index of graphs
- On a construction of integrally invertible graphs and their spectral properties
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- Properties of hydrogen terminated silicon nanocrystals via a transferable tight-binding Hamiltonian, based on ab-initio results
- Solution to the inverse Wulff problem by means of the enhanced semidefinite relaxation method
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(6)- Lifts, discrepancy and nearly optimal spectral gap
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