Table Of Content

Journal of Molecular Structure (Theochem), 229 (1991) 291 Elsevier Science Publishers B.V., Amsterdam AUTHOR INDEX Allan, N.L., 189 Janoschek,R., 197 Poshusta, R.D., 103 Blaise, P., 219 Klein, D.J., 63, 103 Raimondi, M., 155, 279 Breysse, P., 219 Randié, M., 139 Li, X., 249 Collins, J.R., 91 Loades,S.D., 189 Shaik,S.S., 163 Cooper, D.L., 155, 189,279 Léwdin, P.O., 1 Sini,G., 163 Sironi,M., 279 De Boer, K., 15 Maaskant, W.J.A., 15 Maitre, P., 163 Trinajsti¢é, N., 63 Epiotis, N.D., 205 Malrieu, J.P., 219 Maynau,D., 219 Van Lenthe, J.H., 115 Gallup,G.A., 91 McWeeny,R., 29 Verbeek, J., 115 Gerratt, J., 155,279 Mulder, J.J.C., 15 Harcourt, R.D., 39 Nikolié,S., 63 Henri-Rousseau, O., 219 Hiberty, P.C., 163 Paldus, J., 249 Journal of Molecular Structure (Theochem), 229 (1991) 293-294 Elsevier Science Publishers B.V., Amsterdam SUBJECT INDEX “Arrow pushing” Hypercoordination The art of “arrow pushing”: is the hyper- Aspects of hypercoordination and one- conjugation model theoretically justified?, electron delocalizations via increased-va- 205 lence structures, 39 Benzene molecule Increased-valence structures Has the benzene molecule an extra stabil- Aspects of hypercoordination and one- ity?, 197 electron delocalizations via increased-va- Bonding in B.H, lence structures, 39 On the bonding in B,H, and the lone pairs in H,O: the use of localized molecular or- Lone pairs in H,O bitals in spin-coupled calculations, 155 On the bonding in B,H, and the lone pairs in H,O: the use of localized molecular or- bitals in spin-coupled calculations, 155 Cluster expansion Ab initio valence bond cluster expansion for an alternating infinite chain of hydro- Momentum space genatoms, 103 Hybrids and bond formation: excursions Conjugated-circuit model in momentum space, 189 Quantum-mechanical and computational aspects of the conjugated-circuit model, 63 Non-orthogonal matrix elements On the evaluation of non-orthogonal ma- trixelements, 115 Fully benzenoid systems Non-orthogonality problem Fully benzenoid systems revisited, 139 On the historical development of the valence bond method and the non-orthogonality problem, 1 HCN—>CH+N The ab initio spin-coupled description of the process HCN>CH+N, 279 One-electron delocalizations Aspects of hypercoordination and one- H,, systems The transferability of effective exchange electron delocalizations via increased-va- integrals in the non-empirical effective valence structures, 39 lence bond hamiltonian: a minimal basis Oxygen double bond study of H, systems, 219 On the nature of the oxygen double bond, Hybrids and bond formation 29 Hybrids and bond formation: excursions in momentum space, 189 Pariser-Parr-Pople hamiltonian Hydrogen atoms Valence bond approach to the Pariser- Ab initio valence bond cluster expansion Parr-Pople hamiltonian and its applica- for an alternating infinite chain of hydro- tion to simple z-electron systems, 249 genatoms, 103 Hyperconjugation model The art of “arrow pushing”: is the hyper- Resonance structures conjugation model theoretically justified?, A generalized method for the superposi- 205 tion of resonance structures, 91 294 Resonating valence bond Transferability On the enumeration of basis functions for The transferability of effective exchange a double chain of S=1/2 ions: a resonating integrals in the non-empirical effective va- valence bond problem, 15 lence bond hamiltonian: a minimal basis study of H, systems, 219 S=1/2 ions On the enumeration of basis functions for a double chain of S = 1/2 ions: a resonating Valence bond hamiltonian valence bond problem, 15 The transferability of effective exchange Simple z-electron systems integrals in the non-empirical effective va- Valence bond approach to the Pariser- lence bond hamiltonian: a minimal basis Parr-Pople hamiltonian and its applica- study of H, systems, 219 tion to simple z-electron systems, 249 Valence bond method Single bonds On the historical development of the va- Covalent, ionic and resonating single lence bond method and the non-orthogo- bonds, 163 nality problem, 1