-
1
-
-
0037165708
-
-
T.M. Pappenfus, R.J. Chesterfield, C.D. Frisbie, K.R. Mann, J. Casado, J.D. Raff, L.L. Miller, J. Am. Chem. Soc. 124 (2002) 4184.
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 4184
-
-
Pappenfus, T.M.1
Chesterfield, R.J.2
Frisbie, C.D.3
Mann, K.R.4
Casado, J.5
Raff, J.D.6
Miller, L.L.7
-
2
-
-
0037162864
-
-
T.M. Pappenfus, J.D. Raff, E.J. Hukkanen, J.R. Burney, J. Casado, S.M. Drew, L.L. Miller, K.R. Mann, J. Org. Chem. 67 (2002) 6015.
-
(2002)
J. Org. Chem.
, vol.67
, pp. 6015
-
-
Pappenfus, T.M.1
Raff, J.D.2
Hukkanen, E.J.3
Burney, J.R.4
Casado, J.5
Drew, S.M.6
Miller, L.L.7
Mann, K.R.8
-
3
-
-
0037120847
-
-
J. Casado, L.L. Miller, K.R. Mann, T.M. Pappenfus, H. Higuchi, E. Ortí, B. Milián, R. Pou-Amérigo, V. Hernández, J.T. López Navarret, J. Am. Chem. Soc. 124 (2002) 12380s.
-
(2002)
J. Am. Chem. Soc.
, vol.124
-
-
Casado, J.1
Miller, L.L.2
Mann, K.R.3
Pappenfus, T.M.4
Higuchi, H.5
Ortí, E.6
Milián, B.7
Pou-Amérigo, R.8
Hernández, V.9
López Navarret, J.T.10
-
4
-
-
0037129510
-
-
J. Casado, L.L. Miller, K.R. Mann, T.M. Pappenfus, Y. Kanemitsu, E. Ortí, P.M. Viruela, R. Pou-Amérigo, V. Hernández, J.T. López Navarrete, J. Phys. Chem. B 106 (2002) 3872.
-
(2002)
J. Phys. Chem. B
, vol.106
, pp. 3872
-
-
Casado, J.1
Miller, L.L.2
Mann, K.R.3
Pappenfus, T.M.4
Kanemitsu, Y.5
Ortí, E.6
Viruela, P.M.7
Pou-Amérigo, R.8
Hernández, V.9
López Navarrete, J.T.10
-
5
-
-
0037062004
-
-
J. Casado, L.L. Miller, K.R. Mann, T.M. Pappenfus, V. Hernández, J.T. López Navarrete, J. Phys. Chem. B 106 (2002) 3597.
-
(2002)
J. Phys. Chem. B
, vol.106
, pp. 3597
-
-
Casado, J.1
Miller, L.L.2
Mann, K.R.3
Pappenfus, T.M.4
Hernández, V.5
López Navarrete, J.T.6
-
7
-
-
0000624035
-
-
K. Furuya, H. Torii, Y. Furukawa, M. Tasumi, J. Mol. Struct. (Theochem) 424 (1998) 225.
-
(1998)
J. Mol. Struct. (Theochem)
, vol.424
, pp. 225
-
-
Furuya, K.1
Torii, H.2
Furukawa, Y.3
Tasumi, M.4
-
8
-
-
0003838469
-
-
Wiley, Weinheim
-
W. Koch, M.C. Holthausen, A Chemist's Guide to Density Functional Theory, Second ed., Wiley, Weinheim, 2001.
-
(2001)
A Chemist's Guide to Density Functional Theory, Second Ed.
-
-
Koch, W.1
Holthausen, M.C.2
-
10
-
-
33645949559
-
-
M.M. Francl, W.J. Pietro, W.J. Hehre, J.S. Binkley, M.S. Gordon, D.J. Defrees, J.A. Pople, J. Chem. Phys. 77 (1982) 3654.
-
(1982)
J. Chem. Phys.
, vol.77
, pp. 3654
-
-
Francl, M.M.1
Pietro, W.J.2
Hehre, W.J.3
Binkley, J.S.4
Gordon, M.S.5
Defrees, D.J.6
Pople, J.A.7
-
12
-
-
0004133516
-
-
Gaussian Inc., Pittsburgh PA
-
M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, A.G. Baboul, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, C. Gonzalez, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, J.L. Andres, M. Head-Gordon, E.S. Replogle, and J.A. Pople, GAUSSIAN 98, Revision A.7, Gaussian Inc., Pittsburgh PA, 1998.
-
(1998)
GAUSSIAN 98, Revision A.7
-
-
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, 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
Baboul, A.G.36
Stefanov, B.B.37
Liu, G.38
Liashenko, A.39
Piskorz, P.40
Komaromi, I.41
Gomperts, R.42
Martin, R.L.43
Fox, D.J.44
Keith, T.45
Al-Laham, M.A.46
Peng, C.Y.47
Nanayakkara, A.48
Gonzalez, C.49
Challacombe, M.50
Gill, P.M.W.51
Johnson, B.52
Chen, W.53
Wong, M.W.54
Andres, J.L.55
Head-Gordon, M.56
Replogle, E.S.57
Pople, J.A.58
more..
-
14
-
-
0000289695
-
-
V. Hernández, S. Calvo Losada, J. Casado, H. Higuchi, J.T. López Navarrete, J. Phys. Chem. A 104 (2000) 661.
-
(2000)
J. Phys. Chem. A
, vol.104
, pp. 661
-
-
Hernández, V.1
Calvo Losada, S.2
Casado, J.3
Higuchi, H.4
López Navarrete, J.T.5
-
15
-
-
0037604209
-
-
unpublished results
-
J. Casado, L.L. Miller, K.R. Mann, T.M. Pappenfus, E. Ortí, P.M. Viruela, V. Hernández, J.T. López Navarrete, unpublished results.
-
-
-
Casado, J.1
Miller, L.L.2
Mann, K.R.3
Pappenfus, T.M.4
Ortí, E.5
Viruela, P.M.6
Hernández, V.7
López Navarrete, J.T.8
-
18
-
-
0010945546
-
-
E. Faulques, A. Leblanc, P. Molini, M. Decoster, F. Conan, J.E. Guerchais, J. Sala-Pala, Spectrochim. Acta A 51 (1995) 805.
-
(1995)
Spectrochim. Acta A
, vol.51
, pp. 805
-
-
Faulques, E.1
Leblanc, A.2
Molini, P.3
Decoster, M.4
Conan, F.5
Guerchais, J.E.6
Sala-Pala, J.7
-
21
-
-
0030171850
-
-
V. Hernández, J. Casado, F.J. Ramírez, G. Zotti, S. Hotta, J.T. López Navarrete, J. Chem. Phys. 104 (1996) 9271.
-
(1996)
J. Chem. Phys.
, vol.104
, pp. 9271
-
-
Hernández, V.1
Casado, J.2
Ramírez, F.J.3
Zotti, G.4
Hotta, S.5
López Navarrete, J.T.6
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