| gaussian 09, Revision d. 01, Gaussian M Frisch Inc, Wallingford CT 201, 2009 | 146851* | 2009 |
| Gaussian 16 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian, Inc., 2016 | 44800* | 2016 |
| 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 | 17490 | 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 | 9676 | 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 | 8001 | 2003 |
| Gaussian 03, Revision C. 02. Wallingford, CT: Gaussian MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc.[Google Scholar], 2004 | 5138* | 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 | 3823 | 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 | 3711 | 1998 |
| Gaussian Inc MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Wallingford Ct 2009, 2009 | 3335 | 2009 |
| Gaussian 09, rev MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian Inc, Wallingford, 2009 | 2717 | 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 | 2712 | 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 | 2655 | 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 | 2192 | 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 | 1939 | 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 | 1791 | 1998 |
| Anharmonic vibrational properties by a fully automated second-order perturbative approach V Barone The Journal of chemical physics 122 (1), 014108, 2005 | 1684 | 2005 |
| Gaussian 16 Revision C. 01, 2016 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian Inc. Wallingford CT 1, 572, 2016 | 1630 | 2016 |
| Gaussian 03; Gaussian, Inc MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Wallingford, CT 6492, 2004 | 1536 | 2004 |
| 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 | 1369 | 2006 |
| Gaussian 09 Revision A. 02, 2009, Gaussian Inc MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Wallingford CT, 214-218, 2009 | 969* | 2009 |
carlo adamoENSCP - Chimie Paristech確認したメール アドレス: chimie-paristech.fr
