References
- G.A. Molander and C.R. Harris, Chem. Rev. 96, 307–338 (1996). doi: 10.1021/cr950019y
- K.e.C. Nicolaou, S.P. Ellery and J.S. Chen, Angew. Chem. Int. Ed. 48, 7140–7165 (2009). doi: 10.1002/anie.200902151
- G.A. Molander and C.R. Harris, Tetrahedron 54, 3321–3354 (1998). doi: 10.1016/S0040-4020(97)10384-2
- A. Krief and A.-M. Laval, Chem. Rev. 99, 745–778 (1999). doi: 10.1021/cr980326e
- P.G. Steel, J. Chem. Soc., Perkin Trans. 1, 2727–2751 (2001). doi: 10.1039/a908189e
- H.B. Kagan, Tetrahedron 59, 10351–10372 (2003). doi: 10.1016/j.tet.2003.09.101
- D.J. Edmonds, D. Johnston and D.J. Procter, Chem. Rev. 104, 3371–3404 (2004). doi: 10.1021/cr030017a
- M. Hargittai, Coord. Chem. Rev. 91, 35–88 (1988). doi: 10.1016/0010-8545(88)80013-4
- M. Hargittai, Chem. Rev. 100, 2233–2302 (2000). doi: 10.1021/cr970115u
- A. Kovács and R.J. Konings, J. Phys. Chem. Ref. Data 33, 377–404 (2004). doi: 10.1063/1.1595651
- L. Joubert, G. Picard and J.-J. Legendre, Inorg. Chem. 37, 1984–1991 (1998). doi: 10.1021/ic970350v
- C. Adamo and P. Maldivi, J. Phys. Chem. A 102, 6812–6820 (1998). doi: 10.1021/jp980840o
- T. Tsuchiya, T. Taketsugu, H. Nakano and K. Hirao, J. Mol. Struc. (Theochem) 461-462, 203–222 (1999). doi: 10.1016/S0166-1280(98)00461-8
- V. Solomonik and O.Y. Marochko, J. Struct. Chem. (Engl. Transl.) 41, 725–732 (2000).
- C. Adamo and V. Barone, J. Comput. Chem. 21, 1153–1166 (2000). doi: 10.1002/1096-987X(200010)21:13<1153::AID-JCC4>3.0.CO;2-V
- G. Lanza, Z. Varga, M. Kolonits and M. Hargittai, J. Chem. Phys. 128, 074301 (2008). doi: 10.1063/1.2828537
- S. Tsukamoto, H. Mori, H. Tatewaki and E. Miyoshi, Chem. Phys. Lett. 474, 28–32 (2009). doi: 10.1016/j.cplett.2009.04.018
- S. Grimmel, G. Schoendorff and A.K. Wilson, J. Chem. Theory Comput. 12, 1259–1266 (2016). doi: 10.1021/acs.jctc.5b01193
- A. Ramirez-Solis, J.I.n. Amaro-Estrada, J. Hernández-Cobos and L. Maron, Inorg. Chem. 57, 2843–2850 (2018). doi: 10.1021/acs.inorgchem.7b03220
- S. Cotton, Lanthanide and Actinide Chemistry (Wiley, UK, Chichester, 2013).
- D. Aravena, M. Atanasov and F. Neese, Inorg. Chem. 55, 4457–4469 (2016). doi: 10.1021/acs.inorgchem.6b00244
- E. Erokhin, V. Spiridonov, A. Gershikov, N. Raevskii and Y.M. Kiselev, J. Struct. Chem. 25, 407–410 (1984). doi: 10.1007/BF00749332
- Y.S. Ezhov and V. Sevast'yanov, J. Struct. Chem. 45, 160–164 (2004). doi: 10.1023/B:JORY.0000041516.14569.9c
- P. Hohenberg and W. Kohn, Phys. Rev. B 136, B864–B871 (1964). doi: 10.1103/PhysRev.136.B864
- W. Kohn and L.J. Sham, Phys. Rev. A 140, A1133–A1138 (1965). doi: 10.1103/PhysRev.140.A1133
- C. Adamo and V. Barone, J. Chem. Phys. 110, 6158–6170 (1999). doi: 10.1063/1.478522
- A.D. Becke, J. Chem. Phys. 98, 5648–5652 (1993). doi: 10.1063/1.464913
- P. Stephens, F. Devlin, C. Chabalowski and M.J. Frisch, J. Phys. Chem. 98, 11623–11627 (1994). doi: 10.1021/j100096a001
- A.D. Becke, J. Chem. Phys. 104, 1040–1046 (1996). doi: 10.1063/1.470829
- L.E. Aebersold, S.H. Yuwono, G. Schoendorff and A.K. Wilson, J. Chem. Theory Comput. 13, 2831–2839 (2017). doi: 10.1021/acs.jctc.6b01223
- J. Kim, T.K. Kim and H. Ihee, J. Phys. Chem. A 115, 1264–1271 (2011). doi: 10.1021/jp109456v
- M. Dolg, H. Stoll and H. Preuss, J. Chem. Phys. 90, 1730–1734 (1989). doi: 10.1063/1.456066
- X. Cao and M. Dolg, J. Chem. Phys. 115, 7348–7355 (2001). doi: 10.1063/1.1406535
- K.A. Peterson, D. Figgen, E. Goll, H. Stoll and M. Dolg, J. Chem. Phys. 119, 11113–11123 (2003). doi: 10.1063/1.1622924
- K.A. Peterson, B.C. Shepler, D. Figgen and H. Stoll, J. Phys. Chem. A 110, 13877–13883 (2006). doi: 10.1021/jp065887l
- D.E. Woon and T.H. Dunning Jr, J. Chem. Phys. 98, 1358–1371 (1993). doi: 10.1063/1.464303
- M.J. Frisch, M. Head-Gordon and J.A. Pople, Chem. Phys. Lett. 166, 275–280 (1990). doi: 10.1016/0009-2614(90)80029-D
- M. Head-Gordon and T. Head-Gordon, Chem. Phys. Lett. 220, 122–128 (1994). doi: 10.1016/0009-2614(94)00116-2
- G.W.T. Krishnan Raghavachari, J.A. Pople and M. Head-Gordon, Chem. Phys. Lett. 157, 479–483 (1989). doi: 10.1016/S0009-2614(89)87395-6
- A.E. Reed, L.A. Curtiss and F. Weinhold, Chem. Rev. 88, 899–926 (1988). doi: 10.1021/cr00088a005
- M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, G. Scalmani, V. Barone, B. Mennucci, G.A. Petersson, H. Nakatsuji, M. Caricato, X. Li, H.P. Hratchian, A.F. Izmaylov, J. Bloino, G. Zheng, J.L. Sonnenberg, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, J.A. Montgomery Jr., J.E. Peralta, F. Ogliaro, M. Bearpark, J.J. Heyd, E. Brothers, K.N. Kudin, V.N. Staroverov, R. Kobayashi, J. Normand, K. Raghavachari, A. Rendell, J.C. Burant, S.S. Iyengar, J. Tomasi, M. Cossi, N. Rega, N.J. Millam, M. Klene, J.E. Knox, J.B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, R.L. Martin, K. Morokuma, V.G. Zakrzewski, G.A. Voth, P. Salvador, J.J. Dannenberg, S. Dapprich, A.D. Daniels, Ö Farkas, J.B. Foresman, J.V. Ortiz, J. Cioslowski and D.J. Fox, Gaussian09, Revision D.01 (Gaussian, Inc., Wallingford, CT, 2009).
- L. Skripnikov. Chemissian, a computer program to analyze and visualise quantum-chemical calculations. <www.chemissian.com>
- B. Roos, Advances in Chemical Physics; ab Initio Methods in Quantum Chemistry II (Wiley, Chichester, 1987).
- S.R. Langhoff and E.R. Davidson, Int. J. Quantum Chem. 8, 61–72 (1974). doi: 10.1002/qua.560080106
- P.J. Knowles and H.-J. Werner, Chem. Phys. Lett. 145, 514–522 (1988). doi: 10.1016/0009-2614(88)87412-8
- H.J. Werner and P.J. Knowles, J. Chem. Phys. 89, 5803–5814 (1988). doi: 10.1063/1.455556
- H.-J. Werner, P. J. Knowles, G. Knizia, F.R. Manby, M. Schütz, P. Celani, T. Korona, R. Lindh, A. Mitrushenkov, G. Rauhut, K. R. Shamasundar, T. B. Adler, R. D. Amos, A. Bernhardsson, A. Berning, D. L. Cooper, M. J. O. Deegan, A. J. Dobbyn, F. Eckert, E. Goll, C. Hampel, A. Hesselmann, G. Hetzer, T. Hrenar, G. Jansen, C. Köppl, Y. Liu, A. W. Lloyd, R. A. Mata, A. J. May, S. J. McNicholas, W. Meyer, M. E. Mura, A. Nicklaß, D. P. O'Neill, P. Palmieri, D. Peng, K. Pflüger, R. Pitzer, M. Reiher, T. Shiozaki, H. Stoll, A. J. Stone, R. Tarroni, T. Thorsteinsson, M. Wang, MOLPRO, version 2015.1, a package of ab initio programs, 2015 . <http://www.molpro.net>.
- F. Jensen, Introduction to Computational Chemistry (Wiley, Chichester, UK, 2017).
- A. Ramı´rez-Solı´s, J.I. Amaro-Estrada, J. Hernández-Cobos and L. Maron, J. Phys. Chem. A 121, 2293–2297 (2017). doi: 10.1021/acs.jpca.7b00910