A simple treatment to design NBMO degenerate systems in alternant and non-alternant hydrocarbons Yuriko AokiAkira Imamura OriginalPaper Pages: 155 - 180
Structure and electron density distribution of the nitrate ion and urea molecule upon protonation Guus J. M. VeldersDirk Feil OriginalPaper Pages: 195 - 215
Molecular structure of mono- and dicarbonyls of rhodium and palladium I. PápaiA. GoursotD. R. Salahub OriginalPaper Pages: 217 - 235
First-order gradient correction for the exchange-energy density functional for atoms Zhongxiang ZhouP. K. ChattarajChengteh Lee OriginalPaper Pages: 237 - 243
Quadrupole polarizability and hyperpolarizability of carbon monoxide George Maroulis OriginalPaper Pages: 245 - 253
