People
Last update: 16 January 2004

Christian Pomelli

Email: cris@balder.dcci.unipi.it
Website:pcm.dcci.unipi.it

Post Doc, University of Pisa
Ph.D., Sculoa Normale Superiore, Pisa.

Contribution to Gaussian: PCM Solvation model.

• Continuum Solvation
  
• Molecular Electrostatics
  
• Linear Scaling Techniques

V. Barone, M. Cossi, C.S. Pomelli and J. Tomasi, "Effective Generation of Molecular Cavities in Polarizable Continuum Model by DefPol Procedure." Int. J. Quant. Chem., 20 (1999) 1693.

N. Rega, M. Cossi, V. Barone, C.S. Pomelli and J. Tomasi, "Toward an Effective and Reliable Representation of Solvent Effects in the Study of Biochemical Systems." Int. J. Quant. Chem., 73 (1999) 219.

C.S. Pomelli and J. Tomasi, "DefPol: New Procedure to Build Molecular Surfaces and Its Use in Continuum Solvation Methods." J. Comp. Chem., 19 (1998) 1758.

C.S. Pomelli, J. Tomasi, "Ab Initio study of the S_N2 reaction CH₃Cl + Cl- Cl- + CH₃Cl in Supercritical Water with the Polarizable Continuum Model." J. Phys. Chem. A, 101 (1997) 3561.

R. Cammi, M. Cossi, B. Mennucci, C.S. Pomelli and J. Tomasi, "Energy and Energy Derivatives for Molecular Solutes: Perspectives of Application to Hybrid Quantum and Molecular Methods." Int. Jour. Quant. Chem., 60 (1996) 1165.