The numerical integration of a molecular integral using two different techniques D. ReesDeborah J. MooreP. R. Taylor Commentationes Pages: 183 - 188
Integration points for the reduction of boundary conditions N. C. HandyS. F. Boys Commentationes Pages: 195 - 200
A method for selection and use of numerical integration points for molecules with cylindrical symmetry N. C. Handy Commentationes Pages: 201 - 204
SCF LCGO MO studies on the fluoronium ion FH 2 + and its hydrogen bonding interaction with hydrogen fluoride FH G. H. F. DiercksenW. von NiessenW. P. Kraemer Commentationes Pages: 205 - 214
CNDO/2 (complete neglect of differential overlap)-method for third-row molecules H. L. HaseA. Schweig Commentationes Pages: 215 - 220
The use of site symmetry in constructing symmetry adapted functions R. L. Flurry Jr. Commentationes Pages: 221 - 230
An ab initio study of the hydration of alkylammonium groups G. N. James PortAlberte Pullman Commentationes Pages: 231 - 237
Direct calculation of ionization potentials of closed-shell atoms and molecules Lorenz S. Cederbaum Commentationes Pages: 239 - 260
Modes of interconversion in the cycloheptene ring Giorgio FaviniAlberto Nava Commentationes Pages: 261 - 268
On the electronic structure of N2H2. A possible triplet ground state in diazines G. Wagnière Commentationes Pages: 269 - 274
Calculations of singlet and triplet states of some azabenzenes by modified INDO-CI Sis-Yu ChenRichard M. Hedges Commentationes Pages: 275 - 281
