| gaussian 09, Revision d. 01, Gaussian M Frisch Inc, Wallingford CT 201, 2009 | 126535* | 2009 |
| gaussian 09, Revision d. 01, Gaussian M Frisch Inc, Wallingford CT 201, 2009 | 104708* | 2009 |
| gaussian 09, Revision d. 01, Gaussian M Frisch Inc, Wallingford CT 201, 2009 | 94625* | 2009 |
| Toward reliable density functional methods without adjustable parameters: The PBE0 model C Adamo, V Barone The Journal of chemical physics 110 (13), 6158-6170, 1999 | 21179 | 1999 |
| gaussian 09, Gaussian M Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc., Wallingford CT 121, 150-166, 2009 | 12164* | 2009 |
| Quantum calculation of molecular energies and energy gradients in solution by a conductor solvent model V Barone, M Cossi The Journal of Physical Chemistry A 102 (11), 1995-2001, 1998 | 11219 | 1998 |
| Energies, structures, and electronic properties of molecules in solution with the C‐PCM solvation model M Cossi, N Rega, G Scalmani, V Barone Journal of computational chemistry 24 (6), 669-681, 2003 | 9071 | 2003 |
| Ab initio study of solvated molecules: a new implementation of the polarizable continuum model M Cossi, V Barone, R Cammi, J Tomasi Chemical Physics Letters 255 (4-6), 327-335, 1996 | 4119 | 1996 |
| Exchange functionals with improved long-range behavior and adiabatic connection methods without adjustable parameters: The and models C Adamo, V Barone The Journal of chemical physics 108 (2), 664-675, 1998 | 3958 | 1998 |
| Gaussian 09; Gaussian, Inc MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Wallingford, CT 32, 5648-5652, 2009 | 3548 | 2009 |
| New developments in the polarizable continuum model for quantum mechanical and classical calculations on molecules in solution M Cossi, G Scalmani, N Rega, V Barone The Journal of Chemical Physics 117 (1), 43-54, 2002 | 2879 | 2002 |
| A new definition of cavities for the computation of solvation free energies by the polarizable continuum model V Barone, M Cossi, J Tomasi The Journal of chemical physics 107 (8), 3210-3221, 1997 | 2828 | 1997 |
| Time-dependent density functional theory for molecules in liquid solutions M Cossi, V Barone The Journal of chemical physics 115 (10), 4708-4717, 2001 | 2361 | 2001 |
| Geometry optimization of molecular structures in solution by the polarizable continuum model V Barone, M Cossi, J Tomasi Journal of Computational Chemistry 19 (4), 404-417, 1998 | 2042 | 1998 |
| Ab initio study of ionic solutions by a polarizable continuum dielectric model M Cossi, V Barone, B Mennucci, J Tomasi Chemical Physics Letters 286 (3-4), 253-260, 1998 | 1921 | 1998 |
| Anharmonic vibrational properties by a fully automated second-order perturbative approach V Barone The Journal of chemical physics 122 (1), 014108, 2005 | 1857 | 2005 |
| Geometries and properties of excited states in the gas phase and in solution: Theory and application of a time-dependent density functional theory polarizable continuum model G Scalmani, MJ Frisch, B Mennucci, J Tomasi, R Cammi, V Barone The Journal of chemical physics 124 (9), 2006 | 1535 | 2006 |
| Gaussian 09, revision d. 01, gaussian, inc., wallingford ct MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... See also: URL: http://www. gaussian. com 620, 2009 | 1269 | 2009 |
| Gaussian 09 Revision D. 01, 2009 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian Inc. Wallingford CT 51, 2009 | 1162* | 2009 |
| Role and effective treatment of dispersive forces in materials: Polyethylene and graphite crystals as test cases V Barone, M Casarin, D Forrer, M Pavone, M Sambi, A Vittadini Journal of computational chemistry 30 (6), 934-939, 2009 | 921 | 2009 |
carlo adamoENSCP - Chimie ParistechVerified email at chimie-paristech.fr
