summary of DFT and H-bonding



 In response to my question about the suitability of various functionals to
 handle hydrogen bonding, I received the following replies:
 1.)J. Spanget-Larsen: Chem.Phys. 24 (1999)
 2.) Jim Kress' site on his work on the water dimer:
 http://www.kressworks.com/Research/Quantum_Chemistry The
 actual URL is
 quite long, but a search using www.kressworks.com pulls up the site
 listing. The site itself is quite informative and beautifully designed.
 3.)George Papamokos suggested J. Chem. Phys. (2001)  114 (9) 3949.
  I also found a reference for anyone who is approaching 3D ab initio
 periodic structure programs for the first time:
 Rev. Mod. Phys. Vol. 64 Number 4 1045-1097. This review covers a lot of
 ground. It might not be the most recent, but it certainly is a quite
 comprehensive guide to the concepts and theories in modelling the solid
 state.
  Thanks to everyone who answered my questions.
 Mary
 Mary V. O'Connor, Ph.D.
 Rm. 235 Hilgard Hall
 University of California
 Berkeley, CA 94720