TheT 1 state ofp-nitroaniline and related molecules: A CNDO/S study Richard W. BigelowHans-Joachim FreundBernhard Dick Original Investigations Pages: 177 - 194
The enumeration of reaction pathways using Burnside's lemma Timothy J. McLarnan Original Investigations Pages: 195 - 207
A general population analysis preserving the dipole moment Bernard T. TholePetrus Th. van Duijnen Original Investigations Pages: 209 - 221
Calculation of photoelectron spectra of group IV tetrachlorides and carbon tetrahalides by SCF-X α-SW method Ji-Kang ZhuDu LiYuh-Kang Pan Original Investigations Pages: 223 - 233
A study of the nonadiabatic effects in the Li−Li 2 + system: Typical minimum energy paths for the reaction Li+Li 2 + →Li 3 + Jan VojtíkAlena KrtkováRudolf Polák Original Investigations Pages: 235 - 243
A theoretical investigation on the role of solvent in solvolytic reactions Aldo GambaBruno ManunzaMassimo Simonetta Original Investigations Pages: 245 - 253
Search for saddle points of energy hypersurfaces using a multi-dimensional space of “guiding” coordinates Imre BálintMiklós I. Bán Original Investigations Pages: 255 - 268