-
2
-
-
0000496351
-
-
Boullart, W.; Devriendt, K.; Borms, R.; Peeters, J. J. Phys. Chem. 1996, 100, 998-1007
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 998-1007
-
-
Boullart, W.1
Devriendt, K.2
Borms, R.3
Peeters, J.4
-
3
-
-
15044355342
-
-
Taatjes, C. A.; Klippenstein, S. J.; Hansen, N.; Miller, J. A.; Cool, T. A.; Wang, J.; Law, M. E.; Westmoreland, P. R. Phys. Chem. Chem. Phys. 2005, 7, 806-813
-
(2005)
Phys. Chem. Chem. Phys.
, vol.7
, pp. 806-813
-
-
Taatjes, C.A.1
Klippenstein, S.J.2
Hansen, N.3
Miller, J.A.4
Cool, T.A.5
Wang, J.6
Law, M.E.7
Westmoreland, P.R.8
-
6
-
-
2742563092
-
-
Thaddeus, P.; McCarthy, M. C.; Travers, M. J.; Gottlieb, C. A.; Chen, W. Faraday Discuss. 1998, 109, 121-135
-
(1998)
Faraday Discuss.
, vol.109
, pp. 121-135
-
-
Thaddeus, P.1
McCarthy, M.C.2
Travers, M.J.3
Gottlieb, C.A.4
Chen, W.5
-
7
-
-
33847342533
-
-
Hébrard, E.; Dobrijevic, M.; Bénilan, Y.; Raulin, F. J. Photochem. Photobiol. C 2007, 7, 211-230
-
(2007)
J. Photochem. Photobiol. C
, vol.7
, pp. 211-230
-
-
Hébrard, E.1
Dobrijevic, M.2
Bénilan, Y.3
Raulin, F.4
-
8
-
-
33644957608
-
-
Bowling, N. P.; Halter, R. J.; Hodges, J. A.; Seburg, R. A.; Thomas, P. S.; Simmons, C. S.; Stanton, J. F.; McMahon, R. J. J. Am. Chem. Soc. 2006, 128, 3291-3302
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 3291-3302
-
-
Bowling, N.P.1
Halter, R.J.2
Hodges, J.A.3
Seburg, R.A.4
Thomas, P.S.5
Simmons, C.S.6
Stanton, J.F.7
McMahon, R.J.8
-
9
-
-
67650548650
-
-
Thomas, P. S.; Bowling, N. P.; McMahon, R. J. J. Am. Chem. Soc. 2009, 131, 8649-8659
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 8649-8659
-
-
Thomas, P.S.1
Bowling, N.P.2
McMahon, R.J.3
-
10
-
-
0002504506
-
-
Bernheim, R. A.; Kempf, R. J.; Reichenbecher, E. F. J. Magn. Reson. 1970, 3, 5-9
-
(1970)
J. Magn. Reson.
, vol.3
, pp. 5-9
-
-
Bernheim, R.A.1
Kempf, R.J.2
Reichenbecher, E.F.3
-
11
-
-
36849137229
-
-
Bernheim, R. A.; Kempf, R. J.; Gramas, J. V.; Skell, P. S. J. Chem. Phys. 1965, 43, 196-200
-
(1965)
J. Chem. Phys.
, vol.43
, pp. 196-200
-
-
Bernheim, R.A.1
Kempf, R.J.2
Gramas, J.V.3
Skell, P.S.4
-
13
-
-
0030771666
-
-
Seburg, R. A.; McMahon, R. J.; Stanton, J. F.; Gauss, J. J. Am. Chem. Soc. 1997, 119, 10838-10845
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 10838-10845
-
-
Seburg, R.A.1
McMahon, R.J.2
Stanton, J.F.3
Gauss, J.4
-
14
-
-
0037065321
-
-
Horný, L.; Petraco, N. D. K.; Schaefer, H. F., III. J. Am. Chem. Soc. 2002, 124, 14716-14720
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 14716-14720
-
-
Horný, L.1
Petraco, N.D.K.2
Iii., F.S.H.3
-
15
-
-
0036308564
-
-
Mavrandonakis, A.; Mühlhäuser, M.; Froudakis, G. E.; Peyerimhoff, S. D. Phys. Chem. Chem. Phys. 2002, 4, 3318-3321
-
(2002)
Phys. Chem. Chem. Phys.
, vol.4
, pp. 3318-3321
-
-
Mavrandonakis, A.1
Mühlhäuser, M.2
Froudakis, G.E.3
Peyerimhoff, S.D.4
-
16
-
-
2542493231
-
-
Zhang, C.; Cao, Z.; Wu, H.; Zhang, Q. Int. J. Quantum Chem. 2004, 98, 299-308
-
(2004)
Int. J. Quantum Chem.
, vol.98
, pp. 299-308
-
-
Zhang, C.1
Cao, Z.2
Wu, H.3
Zhang, Q.4
-
19
-
-
0003099667
-
-
Hori, Y.; Noda, K.; Kobayashi, S.; Taniguchi, H. Tetrahedron Lett. 1969, 3563-3566
-
(1969)
Tetrahedron Lett.
, pp. 3563-3566
-
-
Hori, Y.1
Noda, K.2
Kobayashi, S.3
Taniguchi, H.4
-
22
-
-
0001151072
-
-
Sander, W.; Bucher, G.; Wierlacher, S. Chem. Rev. 1993, 93, 1583-1621
-
(1993)
Chem. Rev.
, vol.93
, pp. 1583-1621
-
-
Sander, W.1
Bucher, G.2
Wierlacher, S.3
-
24
-
-
67649989351
-
-
Seburg, R. A.; Patterson, E. V.; McMahon, R. J. J. Am. Chem. Soc. 2009, 131, 9442-9455
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 9442-9455
-
-
Seburg, R.A.1
Patterson, E.V.2
McMahon, R.J.3
-
25
-
-
0043210367
-
-
Noro, M.; Koga, N.; Iwamura, H. J. Am. Chem. Soc. 1993, 115, 4916
-
(1993)
J. Am. Chem. Soc.
, vol.115
, pp. 4916
-
-
Noro, M.1
Koga, N.2
Iwamura, H.3
-
26
-
-
33847637524
-
-
DePinto, J. T.; deProphetis, W. A.; Menke, J. L.; McMahon, R. J. J. Am. Chem. Soc. 2007, 129, 2308-2315
-
(2007)
J. Am. Chem. Soc.
, vol.129
, pp. 2308-2315
-
-
Depinto, J.T.1
Deprophetis, W.A.2
Menke, J.L.3
McMahon, R.J.4
-
28
-
-
36448999407
-
-
Fulara, J.; Freivogel, P.; Forney, D.; Maier, J. P. J. Chem. Phys. 1995, 103, 8805-8810
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 8805-8810
-
-
Fulara, J.1
Freivogel, P.2
Forney, D.3
Maier, J.P.4
-
29
-
-
0033688913
-
-
Ball, C. D.; McCarthy, M. C.; Thaddeus, P. J. Chem. Phys. 2000, 112, 10149-10155
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 10149-10155
-
-
Ball, C.D.1
McCarthy, M.C.2
Thaddeus, P.3
-
30
-
-
77957112387
-
-
DOI: 10.1021/jo101125y.
-
Bowling, N. P.; Burrmann, N. J.; Halter, R. J.; Hodges, J. A.; McMahon, R. J. J. Org. Chem. 2010, 75, DOI: 10.1021/jo101125y.
-
(2010)
J. Org. Chem.
, vol.75
-
-
Bowling, N.P.1
Burrmann, N.J.2
Halter, R.J.3
Hodges, J.A.4
McMahon, R.J.5
-
31
-
-
77957160889
-
-
Information available as Supporting Information.
-
Information available as Supporting Information.
-
-
-
-
32
-
-
77957140871
-
-
Ph.D. Dissertation, University of Wisconsin.
-
Thomas, P. S. Ph.D. Dissertation, University of Wisconsin, 2007.
-
(2007)
-
-
Thomas, P.S.1
-
34
-
-
77957133915
-
-
Unpublished results
-
Stanton, J. F. Unpublished results.
-
-
-
Stanton, J.F.1
-
35
-
-
4243749765
-
-
Wierlacher, S.; Sander, W.; Marquardt, C.; Kraka, E.; Cremer, D. Chem. Phys. Lett. 1994, 222, 319-324
-
(1994)
Chem. Phys. Lett.
, vol.222
, pp. 319-324
-
-
Wierlacher, S.1
Sander, W.2
Marquardt, C.3
Kraka, E.4
Cremer, D.5
-
36
-
-
0034820295
-
-
Sander, W.; Block, K.; Kappert, W.; Kirschfeld, A.; Muthusam', S.; Schroeder, K.; Sosa, C. P.; Kraka, E.; Cremer, D. J. Am. Chem. Soc. 2001, 123, 2618-2627
-
(2001)
J. Am. Chem. Soc.
, vol.123
, pp. 2618-2627
-
-
Sander, W.1
Block, K.2
Kappert, W.3
Kirschfeld, A.4
Muthusamy, S.5
Schroeder, K.6
Sosa, C.P.7
Kraka, E.8
Cremer, D.9
-
37
-
-
0000448891
-
-
McMahon, R. J.; Chapman, O. L.; Hayes, R. A.; Hess, T. C.; Krimmer, H.-P. J. Am. Chem. Soc. 1985, 107, 7597-7606
-
(1985)
J. Am. Chem. Soc.
, vol.107
, pp. 7597-7606
-
-
McMahon, R.J.1
Chapman, O.L.2
Hayes, R.A.3
Hess, T.C.4
Krimmer, H.-P.5
-
39
-
-
0004133516
-
-
revision A.6; Gaussian, Inc.: Pittsburgh, PA.
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A., Jr.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Andres, J. L.; Gonzalez, C.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, revision A.6; Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery Jr., J.A.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Gonzalez, C.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Gonzalez, C.55
Head-Gordon, M.56
Replogle, E.S.57
Pople, J.A.58
more..
-
40
-
-
0038626673
-
-
revision B.05; Gaussian, Inc.: Wallingford, CT.
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery, J. A., Jr.; Vreven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Klene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M' C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A. Gaussian 03, revision B.05; Gaussian, Inc.: Wallingford, CT, 2004.
-
(2004)
Gaussian 03
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Montgomery Jr., J.A.7
Vreven, T.8
Kudin, K.N.9
Burant, J.C.10
Millam, J.M.11
Iyengar, S.S.12
Tomasi, J.13
Barone, V.14
Mennucci, B.15
Cossi, M.16
Scalmani, G.17
Rega, N.18
Petersson, G.A.19
Nakatsuji, H.20
Hada, M.21
Ehara, M.22
Toyota, K.23
Fukuda, R.24
Hasegawa, J.25
Ishida, M.26
Nakajima, T.27
Honda, Y.28
Kitao, O.29
Nakai, H.30
Klene, M.31
Li, X.32
Knox, J.E.33
Hratchian, H.P.34
Cross, J.B.35
Bakken, V.36
Adamo, C.37
Jaramillo, J.38
Gomperts, R.39
Stratmann, R.E.40
Yazyev, O.41
Austin, A.J.42
Cammi, R.43
Pomelli, C.44
Ochterski, J.W.45
Ayala, P.Y.46
Morokuma, K.47
Voth, G.A.48
Salvador, P.49
Dannenberg, J.J.50
Zakrzewski, V.G.51
Dapprich, S.52
Daniels, A.D.53
Strain, M.C.54
Farkas, O.55
Malick, D.K.56
Rabuck, A.D.57
Raghavachari, K.58
Foresman, J.B.59
Ortiz, J.V.60
Cui, Q.61
Baboul, A.G.62
Clifford, S.63
Cioslowski, J.64
Stefanov, B.B.65
Liu, G.66
Liashenko, A.67
Piskorz, P.68
Komaromi, I.69
Martin, R.L.70
Fox, D.J.71
Keith, T.72
Al-Laham, M.A.73
Peng, C.Y.74
Nanayakkara, A.75
Challacombe, M.76
Gill, P.M.W.77
Johnson, B.78
Chen, W.79
Wong, M.W.80
Gonzalez, C.81
Pople, J.A.82
more..
-
41
-
-
77957152219
-
-
ACES II MAB; and the integral packages: MOLECULE (;), PROPS (), PROPS and ABACUS (;;;). Available at.
-
Stanton, J. F.; Gauss, J.; Watts, J. D.; Szalay, P. G.; Bartlett, R. J.; Auer, A. A.; Bernholdt, D. E.; Christiansen, O.; Harding, M. E.; Heckert, M.; Heun, O.; Huber, C.; Jonsson, D.; Jusélius, J.; Lauderdale, W. J.; Metzroth, T.; Michauk, C.; Price, D. R.; Ruud, K.; Schiffmann, F.; Tajti, A.; Varner, M. E.; Vázquez, J. ACES II MAB; and the integral packages: MOLECULE (Almlöf, J.; Taylor, P. R.), PROPS (Taylor, P. R.), PROPS and ABACUS (Helgaker, T.; Aa. Jensen, H. J.; Jørgensen, P.; Olsen, J.). Available at: www.aces2.de.
-
-
-
Stanton, J.F.1
Gauss, J.2
Watts, J.D.3
Szalay, P.G.4
Bartlett, R.J.5
Auer, A.A.6
Bernholdt, D.E.7
Christiansen, O.8
Harding, M.E.9
Heckert, M.10
Heun, O.11
Huber, C.12
Jonsson, D.13
Jusélius, J.14
Lauderdale, W.J.15
Metzroth, T.16
Michauk, C.17
Price, D.R.18
Ruud, K.19
Schiffmann, F.20
Tajti, A.21
Varner, M.E.22
Vázquez, J.23
Almlöf, J.24
Taylor, P.R.25
Taylor, P.R.26
Helgaker, T.27
Aa. Jensen, H.J.28
Jørgensen, P.29
Olsen, J.30
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