-
4
-
-
0031209891
-
-
M. Isabel Cabaço, Y. Danten, M. Besnard, Y. Guissani, and B. Guillot, J. Phys. Chem. B 101, 6977 (1997).
-
(1997)
J. Phys. Chem. B
, vol.101
, pp. 6977
-
-
Cabaço, M.I.1
Danten, Y.2
Besnard, M.3
Guissani, Y.4
Guillot, B.5
-
5
-
-
36749121814
-
-
D. R Bauer, G. R. Alms, J. I. Brauman, and R. Pecora, J. Chem. Phys. 61, 2255 (1977).
-
(1977)
J. Chem. Phys.
, vol.61
, pp. 2255
-
-
Bauer, D.R.1
Alms, G.R.2
Brauman, J.I.3
Pecora, R.4
-
15
-
-
0000471049
-
-
B. J. Loughnane, A. Scodinu, R. A. Farrer, J. T. Fourkas, and U. Mohanty, J. Chem. Phys. 111, 2686 (1999).
-
(1999)
J. Chem. Phys.
, vol.111
, pp. 2686
-
-
Loughnane, B.J.1
Scodinu, A.2
Farrer, R.A.3
Fourkas, J.T.4
Mohanty, U.5
-
18
-
-
0000184506
-
-
J. P. Pinan, R. Ouillon, P. Ranson, M. Becucci, and S. Califano, J. Chem. Phys. 109, 5469 (1998).
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 5469
-
-
Pinan, J.P.1
Ouillon, R.2
Ranson, P.3
Becucci, M.4
Califano, S.5
-
19
-
-
0002292128
-
-
edited by I. Prigogine and S. A. Rice Wiley, New York
-
W. A. Steele, Advances in Chemical Physics, edited by I. Prigogine and S. A. Rice (Wiley, New York, 1976). Vol. XXXIV, pp. 1-104.
-
(1976)
Advances in Chemical Physics
, vol.34
, pp. 1-104
-
-
Steele, W.A.1
-
22
-
-
0000910338
-
-
T. Nakagawa, J. Umemura, S. Hayashi, M. Oobatake, Y. Miwa, and K. Machida, Mol. Phys. 88, 1635 (1996).
-
(1996)
Mol. Phys.
, vol.88
, pp. 1635
-
-
Nakagawa, T.1
Umemura, J.2
Hayashi, S.3
Oobatake, M.4
Miwa, Y.5
Machida, K.6
-
23
-
-
0000424733
-
-
B. Ratajska-Gadomska, W. Gadomski, P. Wiewior, and C. Radzewicz, J. Chem. Phys. 108, 8489 (1998).
-
(1998)
J. Chem. Phys.
, vol.108
, pp. 8489
-
-
Ratajska-Gadomska, B.1
Gadomski, W.2
Wiewior, P.3
Radzewicz, C.4
-
24
-
-
84986512474
-
-
B. R. Brooks, R. E. Bruccoleri, B. D. Olafson, D. J. States, S. Swaminathan, and M. Karplus, J. Comput. Chem. 4, 187 (1983).
-
(1983)
J. Comput. Chem.
, vol.4
, pp. 187
-
-
Brooks, B.R.1
Bruccoleri, R.E.2
Olafson, B.D.3
States, D.J.4
Swaminathan, S.5
Karplus, M.6
-
27
-
-
0006835861
-
-
note
-
We thank Professor Charles Wilcox at Cornell University for performing ab initio calculations at different levels on the molecule.
-
-
-
-
28
-
-
0002402076
-
-
G. A. Jeffrey, J. R. Ruble, R. K. McMullan, and J. A. Pople, Proc. R. Soc. London. Ser. A 414, 47 (1987).
-
(1987)
Proc. R. Soc. London. Ser. A
, vol.414
, pp. 47
-
-
Jeffrey, G.A.1
Ruble, J.R.2
McMullan, R.K.3
Pople, J.A.4
-
30
-
-
0010262629
-
-
P. Procacci, T. A. Darden, E. Paci, and M. Marchi, J. Comput. Chem. 18, 1848 (1997).
-
(1997)
J. Comput. Chem.
, vol.18
, pp. 1848
-
-
Procacci, P.1
Darden, T.A.2
Paci, E.3
Marchi, M.4
-
31
-
-
33645961739
-
-
and references therein
-
U. Essmann, L. Perera, M. L. Berkowitz, T. Darden, H. Lee, and L. G. Pedersen, J. Chem. Phys. 103, 8577 (1995), and references therein.
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 8577
-
-
Essmann, U.1
Perera, L.2
Berkowitz, M.L.3
Darden, T.4
Lee, H.5
Pedersen, L.G.6
-
36
-
-
0006347440
-
-
E. L. Bokhenkov, V. G. Fedotov, E. F. Sheka, I. Natkaniec, M. Sudnik-Hrynkiewicz, S. Califano, and R. Righini, Nuovo Cimento Soc. Ital. Fis., B 44B, 324 (1478).
-
(1478)
Nuovo Cimento Soc. Ital. Fis., B
, vol.44 B
, pp. 324
-
-
Bokhenkov, E.L.1
Fedotov, V.G.2
Sheka, E.F.3
Natkaniec, I.4
Sudnik-Hrynkiewicz, M.5
Califano, S.6
Righini, R.7
-
44
-
-
0000982665
-
-
M. A. McCool, A. F. Collings, and L. A. Woolf, J. Chem. Soc., Faraday Trans. 1 68, 1489 (1972).
-
(1972)
J. Chem. Soc., Faraday Trans. 1
, vol.68
, pp. 1489
-
-
McCool, M.A.1
Collings, A.F.2
Woolf, L.A.3
-
49
-
-
0020763563
-
-
G. Karlström. P. Linse, A. Walqvist, and B. Jönsson, J. Am. Chem. Soc. 105, 3777 (1983).
-
(1983)
J. Am. Chem. Soc.
, vol.105
, pp. 3777
-
-
Karlström, G.1
Linse, P.2
Walqvist, A.3
Jönsson, B.4
-
51
-
-
0032558371
-
-
B. D. Bursulaya and H. J. Kim, J. Chem. Phys. 109, 4911 (1998); R. Chelli, S. Ciabatti, G. Cardini, R. Righini, and P. Procacci, ibid. 111, 4218 (1999); 112, 5515 (2000).
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 4911
-
-
Bursulaya, B.D.1
Kim, H.J.2
-
52
-
-
0000381159
-
-
B. D. Bursulaya and H. J. Kim, J. Chem. Phys. 109, 4911 (1998); R. Chelli, S. Ciabatti, G. Cardini, R. Righini, and P. Procacci, ibid. 111, 4218 (1999); 112, 5515 (2000).
-
(1999)
J. Chem. Phys.
, vol.111
, pp. 4218
-
-
Chelli, R.1
Ciabatti, S.2
Cardini, G.3
Righini, R.4
Procacci, P.5
-
53
-
-
0032558371
-
-
B. D. Bursulaya and H. J. Kim, J. Chem. Phys. 109, 4911 (1998); R. Chelli, S. Ciabatti, G. Cardini, R. Righini, and P. Procacci, ibid. 111, 4218 (1999); 112, 5515 (2000).
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 5515
-
-
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