ISSN print edition: 0366-6352 ISSN electronic edition: 1336-9075 Registr. No.: MK SR 9/7 Published monthly

Perturbation study of hydrogen-bonded systems

A. A Hasanein and I. Hubač

Department of Chemistry, Faculty of Science, Alexandria University, Alexandria, Egypt

Abstract:  A diagrammatic many-body Rayleigh—Schrödinger perturbation theory combined with the CNDO/2 Hamiltonian is applied to the study of intermolecular hydrogen bonds in the MeOH...0₂NMe, MeOH...NMe₃, MeOH...OMe₂, and HCOOH...HCOOH systems. The results are discussed in relation to other theoretical approaches and experimentally obtained values.

Full paper in Portable Document Format: 351a15.pdf

Chemical Papers 35 (1) 15–20 (1981)