Embedding and characterization of quantum chemical reaction graphs on two-dimensional orientable surfaces

Harary, Frank; Mezey, Paul G.

1988-03

Citation: Harary, Frank, Mezey, Paul G. (1988/03)."Embedding and characterization of quantum chemical reaction graphs on two-dimensional orientable surfaces." Discrete Applied Mathematics 19(1-3): 205-214. <http://hdl.handle.net/2027.42/27383>

Abstract: Quantum chemical reaction graphs defined on multidimensional potential energy hypersurfaces are embedded on two-dimensional orientable surfaces. Topological invariants of these graphs and those of the embedding two-dimensional surfaces can characterize various families of chemical reactions. Several examples are given for embeddings of reaction graphs of chemical conformational processes.

DOIs: http://dx.doi.org/10.1016/0166-218X(88)90015-7

URI: http://www.sciencedirect.com/science/article/B6TYW-45FT5WM-H/2/657f7800f756d96a0113e05169aff032

Handle: http://hdl.handle.net/2027.42/27383

Show full item record