1. The intermolecular interaction in the charge-transfer complexes between amines and halogens: A theoretical characterization of the trends in halogen bonding

   • Alfred Karpfen

   OriginalPaper 07 August 2003 Pages: 1 - 9

2. A kinetic stability study of MN₅ (M=Li, Na, K, and Rb)

   • Jun Fang Zhao
   • Nan Li
   • Qian Shu Li

   OriginalPaper 23 June 2003 Pages: 10 - 18

3. Ab initio and density functional theory based studies on collagen triplets

   • R. Parthasarathi
   • B. Madhan
   • T. Ramasami

   OriginalPaper 16 May 2003 Pages: 19 - 27

4. Valence ab initio calculation of the potential-energy curves for the Ca₂ dimer

   • E. Czuchaj
   • M. Krośnicki
   • H. Stoll

   OriginalPaper 16 July 2003 Pages: 28 - 33

5. Accuracy of geometries: influence of basis set, exchange–correlation potential, inclusion of core electrons, and relativistic corrections

   • M. Swart
   • J. G. Snijders

   OriginalPaper 16 July 2003 Pages: 34 - 41

6. Test study on the excitation spectra of the N₂–He van der Waals molecule

   • Mary C. Salazar
   • José L. Paz
   • Marcia L. Llanos

   OriginalPaper 16 July 2003 Pages: 42 - 46

7. Comparison of magnetic and thermal properties of prismane and double-cubane [Fe₆S₆]⁴⁺ superclusters

   • M. Czerwiñski
   • M. Matusiewicz

   Erratum 07 August 2003 Pages: 47 - 47