On the role of core repulsion in the prediction of the energy levels of π-conformers G. Del ReF. MomicchioliA. Rastelli Commentationes Pages: 316 - 326
Perturbation theory for excited states of molecules A. T. AmosB. L. Burrows Commentationes Pages: 327 - 335
Application of the MIM method to the study of electronic absorption bands involving triplet states in hydrocarbons Aldo GambaGianfranco TantardiniMassimo Simonetta Commentationes Pages: 336 - 345
Ab initio SCF and CI calculations on the barrier to internal rotation of 1,3-butadiene Bernd Dumbacher Commentationes Pages: 346 - 359
Some remarks on the calculations of hyperfine splittings in the ESR spectra of conjugated radicals Jan WasilewskiWiesław Woźnicki Commentationes Pages: 360 - 368
A theoretical study of the heats of formation of some small molecules using non-empirical wavefunctions A. C. HopkinsonK. YatesI. G. Csizmadia Relationes Pages: 369 - 377
Application of the INDO-MO method to the calculation of hyperfine splitting constants for styrene radical anions D. M. Hirst Relationes Pages: 378 - 382
Direct comparison of EH and CNDO charge distributions for adenine Donald B. Boyd Relationes Pages: 383 - 386
SCF MO LCGO studies on the hydration of ions: The systems H+H2O, Li+H2O, and Na+H2O Geerd H. F. DiercksenWolfgang P. Kraemer Relationes Pages: 387 - 392
SCF MO LCGO studies on the hydration of ions: The system Li+·2H2O Wolfgang P. KraemerGeerd H. F. Diercksen Relationes Pages: 393 - 397
SCF MO LCGO studies on hydrogen bonding: The system (HOHOH)− Wolfgang P. KraemerGeerd H. F. Diercksen Relationes Pages: 398 - 403
