Factors influencing the angle of total Pi-electron energies of alternant hydrocarbons

Date

1997-01-01

Author

Türker, Burhan Lemi

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Within the framework of the Huckel molecular orbital theory, the topological factors affecting the angle of total pi-electron energies of alternant hydrocarbons were investigated.

URI

https://hdl.handle.net/11511/62295

Journal

TURKISH JOURNAL OF CHEMISTRY

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Department of Chemistry, Article

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The angle of total pi-electron energy and localization energies of alternant hydrocarbons Türker, Burhan Lemi (1996-01-01) It has been proved that the localization energies of alternant hydrocarbons correlate linearly with cosines of the angle of total pi-electron energies of the corresponding sigma-complexes in chemical reactions. Topologically variable upper and lower bounds for the topological form of the localization energy are obtained. It has been shown that among the various sigma-complexes of the same compound, the one having the highest a(4) coefficient is more likely to form.
Electrical resistivities of liquid Li-Sn and Na-Pb alloys Khajil, T. M. A.; Tomak, Mehmet (American Physical Society (APS), 1988-06-01) The resistivity of liquid Li-Sn and Na-Pb alloys is calculated using the theory of ‘‘2 k F ’’ scattering theory recently developed by Morgan et al. The partial structure factors are described by the mean-spherical approximation for a system of hard spheres with Yukawa tails. The calculated resistivity values are in very good agreement with experiment. The improvement over the widely used Faber-Ziman formalism is impressive.

Citation Formats

B. L. Türker, “Factors influencing the angle of total Pi-electron energies of alternant hydrocarbons,” TURKISH JOURNAL OF CHEMISTRY, pp. 88–91, 1997, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/62295.