Ab initio effective core potential studies on polymers Hiroyuki TeramaeTokio YamabeAkira Imamura Original Investigations Pages: 1 - 12
Theoretical study of the potential energy curves of the diatomic radicals MeIIX. III. Application to MgCl, CaF and CaCl radicals and some preliminary remarks Rafaele MontagnaniPierluigi RianiOriano Salvetti Original Investigations Pages: 13 - 19
Some unexpected relationships between first, second and third derivative electron repulsion integrals for diatomic and triatomic molecules Mark A. VincentHenry F. Schaefer III Original Investigations Pages: 21 - 26
Effect of hydration on the FH... NH3 proton transfer reaction: Comparison of some quantum chemical approximations János ÁngyánGábor Náray-Szabó Original Investigations Pages: 27 - 30
Many-electron effects in the x-ray emission spectra and the one-particle green's function. Correspondence theorem Anatoly V. KondratenkoLev N. MazalovGennady F. Khudorozhko Original Investigations Pages: 31 - 39
The electronic structures and bonding of some transition-metal monoborides David R. ArmstrongPeter G. PerkinsEugenio A. Cetina V Original Investigations Pages: 41 - 55
Ring functions, as polarization functions, forab initio calculations on small rings: Dioxirane José L. G. de PazManuel Yáñez Original Investigations Pages: 57 - 64