Gaussian 98, revision a. 7, Gaussian MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ...
Inc., Pittsburgh, PA 12, 1998
46524 * 1998 Gaussian 03, revision C. 02 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ...
Gaussian, Inc., Wallingford, CT, 2004
40080 * 2004 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
15578 1999 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
8867 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
7482 2003 Gaussian 03, Revision C. 02. Wallingford, CT: Gaussian MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ...
Inc.[Google Scholar], 2004
6378 * 2004 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
3621 1996 Exchange functionals with improved long-range behavior and adiabatic connection methods without adjustable parameters: The C Adamo, V Barone
The Journal of chemical physics 108 (2), 664-675, 1998
3498 1998 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
2619 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
2581 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
2099 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
1849 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
1719 1998 Anharmonic vibrational properties by a fully automated second-order perturbative approach V Barone
The Journal of chemical physics 122 (1), 014108, 2005
1572 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), 094107, 2006
1278 2006 Toward reliable adiabatic connection models free from adjustable parameters C Adamo, V Barone
Chemical Physics Letters 274 (1-3), 242-250, 1997
827 1997 A state-specific polarizable continuum model time dependent density functional theory method for excited state calculations in solution R Improta, V Barone, G Scalmani, MJ Frisch
The Journal of chemical physics 125 (5), 054103, 2006
756 2006 Accurate excitation energies from time-dependent density functional theory: Assessing the PBE0 model C Adamo, GE Scuseria, V Barone
The Journal of chemical physics 111 (7), 2889-2899, 1999
749 1999 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
745 2009 Transverse polarisation of quarks in hadrons V Barone, A Drago, PG Ratcliffe
Physics reports 359 (1-2), 1-168, 2002
716 2002 
carlo adamoENSCP - Chimie ParistechZweryfikowany adres z chimie-paristech.fr
