A Graph Theoretical and Topological Approach to Chemical Structure, Reactivity, and Dynamics

Abstract

This report summarizes work done by the mathematical chemistry group at the University of Georgia during the period 1984-1988 on applications of graph theory, topology, and group theory to problems in the areas of chemical structure, chemical reactivity, and chemical dynamics. Applications of these theoretical methods to superconductivity, surface science, fuel design, medicine, and environmental technology have been identified. A list of 108 publications arising from this project has been appended. Keywords: Metal clusters, Superconductors, Polyhedra, Symmetry, Molecular connectivity, Fractals, Recurrence relations.

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Document Details

Document Type
Technical Report
Publication Date
Oct 01, 1988
Accession Number
ADA199816

Entities

People

  • R. B. King

Organizations

  • University of Georgia Research Foundation

Tags

Communities of Interest

  • Advanced Electronics
  • Energy and Power Technologies

DTIC Thesaurus Topics

  • Carbonyl Complexes
  • Chemical Compounds
  • Chemical Synthesis
  • Chemistry
  • Computational Science
  • Computer Science
  • Copper Oxides
  • Electron Gas
  • Graph Theory
  • High Temperature
  • Inorganic Chemistry
  • Materials
  • Mathematics
  • Post-Transition Metals
  • Topology
  • Transition Metals
  • Two Dimensional

Fields of Study

  • Physics

Readers

  • Electrochemical Engineering/ Fuel Cell Technologies
  • Graph Algorithms and Convex Optimization.
  • Technical Research and Report Writing.