-
2
-
-
0000918623
-
-
E. W. Castner, Jr., Y. J. Chang, Y. C. Chu, and G. E. Walrafen, J. Chem. Phys. 102, 653 (1995).
-
(1995)
J. Chem. Phys.
, vol.102
, pp. 653
-
-
Castner Jr., E.W.1
Chang, Y.J.2
Chu, Y.C.3
Walrafen, G.E.4
-
3
-
-
36549103625
-
-
G. E. Walrafen, M. R. Fisher, M. S. Hokmabadi, and W. H. Yang, J. Chem. Phys. 85, 6970 (1986).
-
(1986)
J. Chem. Phys.
, vol.85
, pp. 6970
-
-
Walrafen, G.E.1
Fisher, M.R.2
Hokmabadi, M.S.3
Yang, W.H.4
-
4
-
-
51149202652
-
-
C. J. Montrose, J. A. Bucaro, J. Marshall-Coakley, and T. A. Litovitz, J. Chem. Phys. 60, 5025 (1974).
-
(1974)
J. Chem. Phys.
, vol.60
, pp. 5025
-
-
Montrose, C.J.1
Bucaro, J.A.2
Marshall-Coakley, J.3
Litovitz, T.A.4
-
9
-
-
0000135791
-
-
M. Tuckerman, K. Laasonen, M. Sprik, and M. Parrinello, J. Chem. Phys. 103, 150 (1995).
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 150
-
-
Tuckerman, M.1
Laasonen, K.2
Sprik, M.3
Parrinello, M.4
-
11
-
-
0004039485
-
-
Elsevier, Amsterdam, Chap. 2
-
G. Zundel and J. Frisch, The Chemical Physics of Salvation (Elsevier, Amsterdam, 1986), Vol. 2, Chap. 2.
-
(1986)
The Chemical Physics of Salvation
, vol.2
-
-
Zundel, G.1
Frisch, J.2
-
14
-
-
33751385572
-
-
F. R. Tortonda, J. L. Pascual-Ahuir, E. Silla, and I. Tuñón, J. Phys. Chem. 97, 11087 (1983).
-
(1983)
J. Phys. Chem.
, vol.97
, pp. 11087
-
-
Tortonda, F.R.1
Pascual-Ahuir, J.L.2
Silla, E.3
Tuñón, I.4
-
17
-
-
0031034836
-
-
M. E. Tuckerman, D. Marx, M. L. Klein, and M. Parrinello, Science 275, 817 (1997).
-
(1997)
Science
, vol.275
, pp. 817
-
-
Tuckerman, M.E.1
Marx, D.2
Klein, M.L.3
Parrinello, M.4
-
23
-
-
0000098212
-
-
edited by K. B. Lipkowitz and D. B. Boyd VCH, New York
-
S. Scheiner, in Reviews in Computational Chemistry, edited by K. B. Lipkowitz and D. B. Boyd (VCH, New York, 1991), Vol 2, pp. 165-218.
-
(1991)
Reviews in Computational Chemistry
, vol.2
, pp. 165-218
-
-
Scheiner, S.1
-
24
-
-
0001042824
-
-
F. Sim, A. St-Amant, I. Papai, and D. R. Salahub, J. Am. Chem. Soc. 114, 4391 (1992).
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 4391
-
-
Sim, F.1
St-Amant, A.2
Papai, I.3
Salahub, D.R.4
-
27
-
-
4244118545
-
-
I. Tuñón, T. C. Martins-Costa, C. Millot, M. F. Ruiz-López, and J. L. Rivail, J. Comput. Chem. 17, 19 (1996).
-
(1996)
J. Comput. Chem.
, vol.17
, pp. 19
-
-
Tuñón, I.1
Martins-Costa, T.C.2
Millot, C.3
Ruiz-López, M.F.4
Rivail, J.L.5
-
29
-
-
0001458468
-
-
R. V. Stanton, D. S. Hartsough, and K. M. Merz, Jr., J. Phys. Chem. 97, 11868 (1993).
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 11868
-
-
Stanton, R.V.1
Hartsough, D.S.2
Merz Jr., K.M.3
-
33
-
-
0010922186
-
-
Gaussian, Inc., Pittsburgh, PA
-
GAUSSIAN 94 (Revision C.3), M. J. Frisch, G. W. Trucks, H. B. Schlegel, P. M. W. Gill, B. G. Johnson, M. A. Robb, J. R. Cheeseman, T. A. Keith, G. A. Petersson, J. A. Montgomery, K. Raghavacahri, M. A. Al-Laham, V. G. Zakrzewski, J. V. Ortiz, J. B. Foresman, C. Y. Peng, P. Y. Ayala, M. W. Wong, J. L. Andres, E. S. Replogle, R. Gomperts, R. L. Martin, D. J. Fox, J. S. Binkley, D. J. Defrees, J. Baker, J. P. Stewart, M. Head-Gondon, C. Gonzalez, and J. A. Pople (Gaussian, Inc., Pittsburgh, PA, 1995).
-
(1995)
GAUSSIAN 94 (Revision C.3)
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Robb, M.A.6
Cheeseman, J.R.7
Keith, T.A.8
Petersson, G.A.9
Montgomery, J.A.10
Raghavacahri, K.11
Al-Laham, M.A.12
Zakrzewski, V.G.13
Ortiz, J.V.14
Foresman, J.B.15
Peng, C.Y.16
Ayala, P.Y.17
Wong, M.W.18
Andres, J.L.19
Replogle, E.S.20
Gomperts, R.21
Martin, R.L.22
Fox, D.J.23
Binkley, J.S.24
Defrees, D.J.25
Baker, J.26
Stewart, J.P.27
Head-Gondon, M.28
Gonzalez, C.29
Pople, J.A.30
more..
-
37
-
-
0004016501
-
-
W. L. Jorgensen, R. W. Impey, J. Chandrasekhar, J. D. Madura, and M. L. Klein, J. Chem. Phys. 79, 926 (1983).
-
(1983)
J. Chem. Phys.
, vol.79
, pp. 926
-
-
Jorgensen, W.L.1
Impey, R.W.2
Chandrasekhar, J.3
Madura, J.D.4
Klein, M.L.5
-
39
-
-
0000026966
-
-
G. J. Martyna, M. E. Tuckerman, D. J. Tobias, and M. L. Klein, Mol. Phys. 87, 1117 (1996).
-
(1996)
Mol. Phys.
, vol.87
, pp. 1117
-
-
Martyna, G.J.1
Tuckerman, M.E.2
Tobias, D.J.3
Klein, M.L.4
-
45
-
-
36448999094
-
-
M. E. Tuckerman, B. J. Berne, G. J. Martyna, and M. L. Klein, J. Chem. Phys. 99, 2796 (1993).
-
(1993)
J. Chem. Phys.
, vol.99
, pp. 2796
-
-
Tuckerman, M.E.1
Berne, B.J.2
Martyna, G.J.3
Klein, M.L.4
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