Becke AD (1993) J Chem Phys 98:5648
Perdew JP, Ruzsinszky A, Constantin LA, Sun J, Csonka GI (2009) J Chem Theory Comput 5:902
Adamo C, Barone V (1999) J Chem Phys 110:6158
Boese AD, Martin JML (2004) J Chem Phys 121:3405
Zhao Y, Schultz NE, Truhlar DG (2006) J Chem Theory Comput 2:364
Zhao Y, Truhlar DG (2008) Acc Chem Res 41:157
Grimme S (2006) J Chem Phys 124:034108
Schwabe T, Grimme S (2006) Phys Chem Chem Phys 8:4398
Grimme S, Neese F (2007) J Chem Phys 127:154116
Savin A (1966) In: Seminario JM (eds) Recent developments and applications of modern density functional theory, Chap 9. Elsevier, Amsterdam, pp 327–354
Leininger T, Stoll H, Werner HJ, Savin A (1997) Chem Phys Lett 275:151
Toulouse J, Colonna F, Savin A (2004) Phys Rev A 70:062505
Iikura H, Tsuneda T, Yanai T, Hirao K (2001) J Chem Phys 115:3540
Tawada T, Tsuneda T, Yanagisawa S, Yanai T, Hirao K (2004) J Chem Phys 120:8425
Chiba M, Tsuneda T, Hirao K (2006) J Chem Phys 124:144106
Yanai T, Tew DP, Handy NC (2004) Chem Phys Lett 393:51
Yanai T, Harrison RJ, Handy NC (2005) Mol Phys 103:413
Vydrov OA, Scuseria GE (2006) J Chem Phys 125:234109
Vydrov OA, Heyd J, Krukau V, Scuseria GE (2006) J Chem Phys 125:074106
Livshits E, Baer R (2007) Phys Chem Chem Phys 9:2932
Chai JD, Head-Gordon M (2008) J Chem Phys 128:084106
Chai JD, Head-Gordon M (2008) Phys Chem Chem Phys 10:6615
Sekino H, Maeda Y, Kamiya M (2005) Mol Phys 103:2183
Kamiya M, Sekino H, Tsuneda T, Hirao K (2005) J Chem Phys 122:234111
Jacquemin D, Perpète EA, Medved’ M, Scalmani G, Frisch MJ, Kobayashi R, Adamo C (2007) J Chem Phys 126:191108
Jacquemin D, Perpète EA, Ciofini I, Adamo C (2008) J Comput Chem 29:921
Kishi R, Bonness S, Yoneda K, Takahashi H, Nakano M, Botek E, Champagne B, Kubo T, Kamada K, Ohta K, Tsuneda T (2010) J Chem Phys 132:094107
Jacquemin D, Perpète EA, Scalmani G, Frisch MJ, Kobayashi R, Adamo C (2007) J Chem Phys 126:144105
Peach MJG, Tellgren E, Salek P, Helgaker T, Tozer DJ (2007) J Phys Chem A 111:11930
Runge E, Gross EKU (1984) Phys Rev Lett 52:997
Casida ME (1995) Dsgr. In: Chong DP (ed) Time-dependent density-functional response theory for molecules, volume 1 of Recent advances in density functional methods. World Scientific, Singapore, pp 155–192
Rudberg E, Salek P, Helgaker T, Agren H (2005) J Chem Phys 123:184108
Cai ZL, Crossley MJ, Reimers JR, Kobayashi R, Amos RD (2006) J Phys Chem B 110:15624
Kobayashi R, Amos RD (2006) Chem Phys Lett 420:106
Lange AW, Rohrdanz MA, Herbert JM (2008) J Phys Chem B 112:6304
Jensen L, Govind N (2009) J Phys Chem A 113:9761
Aittala PJ, Cramariuc O, Hukka TI (2010) J Chem Theory Comput 6:805
Peach MJG, Cohen AJ, Tozer DJ (2006) Phys Chem Chem Phys 8:4543
Peach MJG, Benfield P, Helgaker T, Tozer DJ (2008) J Chem Phys 128:044118
Rohrdanz MA, Herbert JM (2008) J Chem Phys 129:034107
Rohrdanz MA, Martins KM, Herbert JM (2009) J Chem Phys 130:054112
Jacquemin D, Perpète EA, Vydrov OA, Scuseria GE, Adamo C (2007) J Chem Phys 127:094102
Jacquemin D, Perpète EA, Scuseria GE, Ciofini I, Adamo C (2008) J Chem Theory Comput 4:123
Jacquemin D, Perpète EA, Scuseria GE, Ciofini I, Adamo C (2008) Chem Phys Lett 465:226
Jacquemin D, Wathelet V, Perpète EA, Adamo C (2009) J Chem Theory Comput 5:2420
Caricato M, Trucks GW, Frisch MJ, Wiberg KB (2010) J Chem Theory Comput 6:370
Jacquemin D, Perpète EA, Ciofini I, Adamo C (2010) J Chem Theory Comput 6:1532
Jacquemin D, Perpète EA, Ciofini I, Adamo C, Valero R, Zhao Y, DG Truhlar (2010) J Chem Theory Comput 6:2071
Schreiber M, Silva-Junior MR, Sauer SPA, Thiel W (2008) J Chem Phys 128:134110
Silva-Junior MR, Schreiber M, Sauer SPA, Thiel W (2008) J Chem Phys 129:104103
Sauer SPA, Schreiber M, Silva-Junior MR, Thiel W (2009) J Chem Theory Comput 5:555
Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Cheeseman JR, Scalmani G, Barone V, Mennucci B, Petersson GA, Nakatsuji H, Caricato M, Li X, Hratchian HP, Izmaylov AF, Bloino J, Zheng G, Sonnenberg JL, Hada M, Ehara M, Toyota K, Fukuda R, Hasegawa J, Ishida M, Nakajima T, Honda Y, Kitao O, Nakai H, Vreven T, Montgomery JA Jr, Peralta JE, Ogliaro F, Bearpark M, Heyd JJ, Brothers E, Kudin KN, Staroverov VN, Kobayashi R, Normand J, Raghavachari K, Rendell A, Burant JC, Iyengar SS, Tomasi J, Cossi M, Rega N, Millam JM, Klene M, Knox JE, Cross JB, Bakken V, Adamo C, Jaramillo J, Gomperts R, Stratmann RE, Yazyev O, Austin AJ, Cammi R, Pomelli C, Ochterski JW, Martin RL, Morokuma K, Zakrzewski VG, Voth GA, Salvador P, Dannenberg JJ, Dapprich S, Daniels AD, Farkas O, Foresman JB, Ortiz JV, Cioslowski J, Fox DJ (2009) Gaussian 09 Revision A.02, Gaussian Inc., Wallingford CT
Becke AD (1997) J Chem Phys 107:8544
Goerigk L, Moellmann J, Grimme S (2009) Phys Chem Chem Phys 11:4611
Silva-Junior MR, Thiel W (2010) J Chem Theory Comput 6:1546
Silva-Junior MR, Sauer SPA, Schreiber M, Thiel W (2010) Mol Phys 108:453
Jacquemin D, Perpète EA, Ciofini I, Adamo C (2009) Acc Chem Res 42:326
Ernzerhof M, Scuseria GE (1999) J Chem Phys 110:5029
Adamo C, Scuseria GE, Barone V (1999) J Chem Phys 111:2889
Tomasi J, Mennucci B, Cammi R (2005) Chem Rev 105:2999
For the records, the reader should be aware that the details of the PCM parameters (UAKS/UA0 radii, presence/absence of smoothing spheres...) might vary from one family of dye to the other
Cossi R, Barone V (2001) J Chem Phys 115:4708
Dierksen M, Grimme S (2004) J Phys Chem A 108:10225
Santoro F, Improta R, Lami A, Bloino J, Barone V (2007) J Chem Phys 126:184102
Jacquemin D, Peltier C, Ciofini I (2010) Chem Phys Lett 493:67
Goerigk L, Grimme S (2010) J Chem Phys 132:184103
Jacquemin D, Preat J, Wathelet V, Fontaine M, Perpète EA (2006) J Am Chem Soc 128:2072
Jacquemin D, Bouhy M, Perpète EA (2006) J Chem Phys 124:204321
Jacquemin D, Michaux C, Perpète EA, Maurel F, Perrier A (2010) Chem Phys Lett 488:193
Perrier A, Maurel F, Perpète EA, Wathelet V, Jacquemin D (2009) J Phys Chem A 113:13004
Schreiber M, Bub V, Fülscher MP (2001) Phys Chem Chem Phys 3:3906
