An MO study of bridge bonds in B2H6 Shinichi YamabeTsutomu MinatoKenichi Fukui Commentationes Pages: 187 - 201
Selection of configurations for SCF-CI calculations of spectral properties and comparison with TDHF calculations John W. DowningJosef MichlErik W. Thulstrup Commentationes Pages: 203 - 216
Molecular orbital calculation of hyperfine interactions, electric field gradient and quadrupole splitting in reduced rubredoxins Gilda H. LoewDavid Y. Lo Commentationes Pages: 217 - 226
Electronic structure of linear halogen compounds Peter A. StraubA. D. McLean Commentationes Pages: 227 - 242
Calcul théorique des polarisabilités électroniques moléculaires. Comparaison des différentes méthodes Daniel RinaldiJean -Louis Rivail Commentationes Pages: 243 - 251
Hartree-Fock calculation of the harmonic force constants and equilibrium geometry of formaldehyde Wilfried MeyerPéter Pulay Commentationes Pages: 253 - 264
The diagrammatic perturbation theory for the interaction of two molecular systems treated by the extended Hückel theory V. LaurincI. HubačV. Kvasnička Commentationes Pages: 265 - 272
SCF LCAO MO calculations for the iso-electronic series ClO 4 − , SO 4 2− , and PO 4 3− Helge Johansen Commentationes Pages: 273 - 278
