- ISSN 0010-0765 printed
- ISSN 1212-6950 electronic
2003, Volume 68, Issue 1
General, Theoretical and Physical Chemistry
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pp. 1-22
Cono Di Paola, Franco A. Gianturco*, Gerardo Delgado-Barrio, Salvador Miret-Artés and Pablo Villarreal The 4He Trimer: Structure and Energetics of a Very Unusual Molecule -
pp. 23-34
Marta Mrákavová, Milan Melicherčík, Anna Olexová and Ľudovít Treindl* The Autocatalytic Reduction of Ferriin by Malonic Acid with Regard to the Ferroin-Catalyzed Belousov-Zhabotinsky Reaction -
pp. 35-46
Vladimír Lukeš, Viliam Laurinc*, Michal Ilčin and Stanislav Biskupič Ab initio Study of the Li-CO van der Waals Complex -
pp. 47-60
Devarajan Ajitha, Kimihiko Hirao and Sourav Pal* Energies and Dipole Moments of Excited States of Ozone and Ozone Radical Cation Using Fock Space Multireference Coupled-Cluster Analytical Response Approach -
pp. 61-74
Peter Politzer*, Abraham F. Jalbout and Ping Jin Some Approximate Atomic and Molecular Energy Formulas -
pp. 75-88
Ivan Černušák*, Alena Zavažanová, Juraj Raab and Pavel Neogrády Group IIIa Hydrides XH2 and XH2- (X = B, Al, Ga): Electron Affinities and Singlet-Triplet Splittings Revisited -
pp. 89-104
Stanislav Záliš*, Antonín Vlček, Jr. and Chantal Daniel The Character of Low-Lying Excited States of Mixed-Ligand Metal Carbonyls. TD-DFT and CASSCF/CASPT2 Study of [W(CO)4L] (L = ethylenediamine, N,N'-dialkyl-1,4-diazabutadiene) and [W(CO)5L] (L = pyridine, 4-cyanopyridine) -
pp. 105-138
Leszek Meissner* and JarosłaW Gryniaków Effective Hamiltonian and Intermediate Hamiltonian Formulations of the Fock-Space Coupled-Cluster Method -
pp. 139-177
Vladimír Kvasnička* and Jiří Pospíchal Artificial Chemistry and Molecular Darwinian Evolution in silico -
pp. 178-188
Libor Mrázek, Ján Žabka, Zdeněk Dolejšek and Zdeněk Herman* Charge Transfer Between CO22+ and Ar or Ne at Collision Energies 3-10 eV -
pp. 189-201
Timothy J. Lee*, Christopher E. Dateo, Mercedes Rubio and Björn O. Roos An Accurate Quartic Force Field and Fundamental Frequencies for the Ozonide Anion: A Rare Positive Anharmonicity for the Antisymmetric Stretch
Organic, Bioorganic and Medicinal Chemistry
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pp. 202-210
B. Andes Hess, Jr. On the Concerted Ring Opening of Protonated Squalene Oxide and A-Ring Formation in the Biosynthesis of Lanosterol
* In paper with more than one author, the asterisk indicates the name of the author to whom correspondence should be addressed.
