Crystal field calculation of g values and zero-field splitting for high spin ferric complexes of rhombic character Amy S. RispinMitsuo SatoHideo Kon Original Investigations Pages: 95 - 116
The effect of substitution on the properties of a chemical group Caterina GhioEolo ScroccoJacopo Tomasi Original Investigations Pages: 117 - 134
On the use of localized orbitals and restricted alternant orbitals in chemical systems Daniel PeetersGeorges Leroy Original Investigations Pages: 135 - 144
Orbital interactions in anti- and syn- tricyclooctadienes and their homoderivatives Jens Spanget-LarsenRolf GleiterCharles R. Degenhardt Original Investigations Pages: 145 - 158
Non-empirical pseudopotentials (PSIBMOL algorithm) for molecular calculations: The Rh2Cl2(CO)4 complex Alain SerafiniRené PoilblancJean-Claude Barthelat Original Investigations Pages: 159 - 167
Conformational analysis of dimethylphosphate with quantum-mechanical and classical methods Giovanni LipariCamillo Tosi Original Investigations Pages: 169 - 179
Calculation of vertical ionization potentials of ketene by perturbation corrections to Koopmans' theorem D. P. Chong Short Communication Pages: 181 - 184