gaussian 09, Revision d. 01, Gaussian M Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc., Wallingford CT 201, 2009 | 129237* | 2009 |

gaussian 09, Revision d. 01, Gaussian M Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Inc., Wallingford CT 201, 2009 | 80099* | 2009 |

Gaussian 03 Programmer's Reference MJ Frisch, AB Nielsen Gaussian, 2003 | 40618* | 2003 |

gaussian M Frisch http://www. gaussian. com/, 2009 | 37439* | 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 | 11085 | 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 | 7060 | 1998 |

Exploring chemistry J Foresman, E Frish Gaussian Inc., Pittsburg, USA, 1996 | 6073 | 1996 |

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 | 5914 | 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 | 3084 | 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 | 2930 | 1998 |

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 | 2339 | 1997 |

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 | 2326 | 2002 |

Time-dependent density functional theory for molecules in liquid solutions M Cossi, V Barone The Journal of chemical physics 115 (10), 4708-4717, 2001 | 1781 | 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 | 1655 | 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 | 1532 | 1998 |

Anharmonic vibrational properties by a fully automated second-order perturbative approach V Barone The Journal of chemical physics 122 (1), 014108, 2005 | 1305 | 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 | 991 | 2006 |

Toward reliable adiabatic connection models free from adjustable parameters C Adamo, V Barone Chemical Physics Letters 274 (1-3), 242-250, 1997 | 746 | 1997 |

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 | 638 | 1999 |

Hasegawa MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Ishida, M, 2003 | 618 | 2003 |