1. Use of Digital Object Identifiers

   Editorial Pages: 357 - 357

2. Modification of Guest and Saunders open shell SCF equations to exclude BSSE from molecular interaction calculations

   • A. Famulari
   • E. Gianinetti
   • I. Vandoni

   Regular article Pages: 358 - 365

3. Relativistic and nonrelativistic finite nucleus optimized double zeta basis sets for the 4p, 5p and 6p elements

   • Kenneth G. Dyall

   Regular article Pages: 366 - 371

4. Counterpoise-corrected potential energy surfaces of simple H-bonded systems

   • Pavel Hobza
   • Zdenvk Havlas

   Regular article Pages: 372 - 377

5. The structure and energetics of cryolite melts

   • M. Micov
   • L. Turi Nagy
   • P. Perichta

   Regular article Pages: 378 - 383

6. Calculation of macroscopic first- and third-order optical susceptibilities for the benzene crystal

   • H. Reis
   • S. Raptis
   • R. W. Munn

   Regular article Pages: 384 - 390

7. Towards an order-N DFT method

   • C. Fonseca Guerra
   • J. G. Snijders
   • E. J. Baerends

   Regular article Pages: 391 - 403

8. Direct subduction of Q-conjugacy representations to give characteristic monomials for combinatorial enumeration

   • Shinsaku Fujita

   Regular article Pages: 404 - 410

9. A theoretical study of substituent effects on the structure of isolated and condensed three-membered rings. A comparison between radicals and parent hydrocarbons

   • Roger Arnaud
   • Robert Subra
   • Vincenzo Barone

   Regular article Pages: 411 - 419

10. Efficient boundary basis functions for time-independent quantum scattering calculations

    • Hyo Weon Jang

    Regular article Pages: 420 - 425

11. The saddle point of the nucleophilic substitution reaction Cl− + CH3Cl: results of large-scale coupled cluster calculations

    • Peter Botschwina

    Letter Pages: 426 - 428