-
6
-
-
0001341249
-
-
M. S. Gordon, K. K. Baldridge, D. E. Bernholdt, and R. J. Bartlett, Chem. Phys. Lett. 158, 189 (1989).
-
(1989)
Chem. Phys. Lett.
, vol.158
, pp. 189
-
-
Gordon, M.S.1
Baldridge, K.K.2
Bernholdt, D.E.3
Bartlett, R.J.4
-
13
-
-
0033559371
-
-
F. J. Aoiz, L. Bañares, J. F. Castillo, M. Menéndez, and J. E. Verdasco, Phys. Chem. Chem. Phys. 1, 1149 (1999).
-
(1999)
Phys. Chem. Chem. Phys.
, vol.1
, pp. 1149
-
-
Aoiz, F.J.1
Bañares, L.2
Castillo, J.F.3
Menéndez, M.4
Verdasco, J.E.5
-
15
-
-
0000780855
-
-
B. Ramachandran, E. A. Schrader III, J. Senekowitsch, and R. E. Wyatt, J. Chem. Phys. 111, 3862 (1999).
-
(1999)
J. Chem. Phys.
, vol.111
, pp. 3862
-
-
Ramachandran, B.1
Schrader III, E.A.2
Senekowitsch, J.3
Wyatt, R.E.4
-
18
-
-
36449009146
-
-
R. Zhang, W. J. van der Zande, M. J. Bronikowski, and R. N. Zare, ibid. 94, 2074 (1991).
-
(1991)
J. Chem. Phys.
, vol.94
, pp. 2704
-
-
Zhang, R.1
Van Der Zande, W.J.2
Bronikowski, M.J.3
Zare, R.N.4
-
19
-
-
0002000203
-
-
edited by M. Baer (CRC, Boca Raton, FL)
-
D. G. Truhlar, A. D. Issacson, and B. C. Garrett, in Theory of Chemical Reaction Dynamics, edited by M. Baer (CRC, Boca Raton, FL, 1985), Vol. 4, p. 65.
-
(1985)
Theory of Chemical Reaction Dynamics
, vol.4
, pp. 65
-
-
Truhlar, D.G.1
Issacson, A.D.2
Garrett, B.C.3
-
20
-
-
0035932711
-
-
S. Skokov, S. Zou, J. M. Bowman, T. C. Allison, D. G. Truhlar, Y. Lin, B. Ramachandran, B. C. Garrett, and B. J. Lynch, J. Phys. Chem. A 105, 2298 (2001).
-
(2001)
J. Phys. Chem. A
, vol.105
, pp. 2298
-
-
Skokov, S.1
Zou, S.2
Bowman, J.M.3
Allison, T.C.4
Truhlar, D.G.5
Lin, Y.6
Ramachandran, B.7
Garrett, B.C.8
Lynch, B.J.9
-
21
-
-
0034230297
-
-
S. Skokov, T. Tsuchida, S. Nanbu, J. M. Bowman, and S. K. Gray, J. Chem. Phys. 113, 227 (2000).
-
(2000)
J. Chem. Phys.
, vol.113
, pp. 227
-
-
Skokov, S.1
Tsuchida, T.2
Nanbu, S.3
Bowman, J.M.4
Gray, S.K.5
-
22
-
-
0034230061
-
-
K. Nobusada, H. Nakamura, Y. Lin, and B. Ramachandran, J. Chem. Phys. 113, 1018 (2000).
-
(2000)
J. Chem. Phys.
, vol.113
, pp. 1018
-
-
Nobusada, K.1
Nakamura, H.2
Lin, Y.3
Ramachandran, B.4
-
24
-
-
4143095330
-
-
R. A. Kendall, T. H. Dunning, Jr., and R. J. Harrison, ibid. 96, 6796 (1992)
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 6796
-
-
Kendall, R.A.1
Dunning Jr., T.H.2
Harrison, R.J.3
-
27
-
-
0010408411
-
-
K. A. Peterson, D. E. Woond, and T. H. Dunning, Jr., J. Chem. Phys. 100, 7410 (1994).
-
(1994)
J. Chem. Phys.
, vol.100
, pp. 7410
-
-
Peterson, K.A.1
Woond, D.E.2
Dunning Jr., T.H.3
-
32
-
-
0037149752
-
-
B. Ruscic, A. F. Wagner, L. B. Harding, R. L. Asher, D. Feller, D. A. Dixon, K. A. Peterson, Y. Song, X. Qian, C.-Y. Ng, J. Liu, W. Chen, and D. W. Schwenke, J. Phys. Chem. A 106, 2727 (2002).
-
(2002)
J. Phys. Chem. A
, vol.106
, pp. 2727
-
-
Ruscic, B.1
Wagner, A.F.2
Harding, L.B.3
Asher, R.L.4
Feller, D.5
Dixon, D.A.6
Peterson, K.A.7
Song, Y.8
Qian, X.9
Ng, C.-Y.10
Liu, J.11
Chen, W.12
Schwenke, D.W.13
-
33
-
-
0345475380
-
-
following paper
-
T. Xie, J. M. Bowman, K. A. Peterson, and B. Ramachandran, J. Chem. Phys. 119, 9601 (2003), following paper.
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 9601
-
-
Xie, T.1
Bowman, J.M.2
Peterson, K.A.3
Ramachandran, B.4
-
34
-
-
0037206815
-
-
C.-C. Hsiao, Y.-P. Lee, N. S. Wang, J. H. Wang, and M. C. Lin, J. Phys. Chem. A 106, 10 231 (2002).
-
(2002)
J. Phys. Chem. A
, vol.106
, pp. 10231
-
-
Hsiao, C.-C.1
Lee, Y.-P.2
Wang, N.S.3
Wang, J.H.4
Lin, M.C.5
-
39
-
-
4143095330
-
-
R. A. Kendall, T. H. Dunning, Jr., and R. J. Harrison, J. Chem. Phys. 96, 6796 (1992)
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 6796
-
-
Kendall, R.A.1
Dunning Jr., T.H.2
Harrison, R.J.3
-
41
-
-
0035366784
-
-
T. H. Dunning, Jr., K. A. Peterson, and A. K. Wilson, J. Chem. Phys. 114, 9244 (2001) and references therein.
-
(2001)
J. Chem. Phys.
, vol.114
, pp. 9244
-
-
Dunning Jr., T.H.1
Peterson, K.A.2
Wilson, A.K.3
-
48
-
-
0006244148
-
-
K. Raghavachari, G. W. Trucks, J. A. Pople, and M. Head-Gordon, Chem. Phys. Lett. 157, 179 (1989).
-
(1989)
Chem. Phys. Lett.
, vol.157
, pp. 479
-
-
Raghavachari, K.1
Trucks, G.W.2
Pople, J.A.3
Head-Gordon, M.4
-
54
-
-
0344609756
-
-
ACES II, a program product of the Quantum Theory Project, University of Florida. Integral packages included are VMOL (J. Almlöf and P. R. Taylor); VPROPS (P. Taylor); ABACUS (T. Helgaker, H. J. Aa. Jensen, P. Jørgensen, J. Olsen, and P. R. Taylor), and ACESII (v3.0)
-
J. F. Stanton, J. Gauss, J. D. Watts et al., ACES II, a program product of the Quantum Theory Project, University of Florida. Integral packages included are VMOL (J. Almlöf and P. R. Taylor); VPROPS (P. Taylor); ABACUS (T. Helgaker, H. J. Aa. Jensen, P. Jørgensen, J. Olsen, and P. R. Taylor), and ACESII (v3.0), 1999.
-
(1999)
-
-
Stanton, J.F.1
Gauss, J.2
Watts, J.D.3
-
55
-
-
0004133516
-
-
Gaussian, Inc., Pittsburgh, PA
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel et al., GAUSSIAN 98, Revision A.11.2, Gaussian, Inc., Pittsburgh, PA, 2001.
-
(2001)
GAUSSIAN 98, Revision A.11.2
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
-
56
-
-
0345040721
-
-
note
-
H.-J. Werner and P. J. Knowles with contributions from J. Almlöf, R. D. Amos, A. Bernhardsson et al., MOLPRO 2000, a package of ab initio programs.
-
-
-
-
58
-
-
36549097287
-
-
D. W. Schwenke, R. Steckler, F. B. Brown, and D. G. Truhlar, J. Chem. Phys. 84, 5706 (1986)
-
(1986)
J. Chem. Phys.
, vol.84
, pp. 5706
-
-
Schwenke, D.W.1
Steckler, R.2
Brown, F.B.3
Truhlar, D.G.4
-
59
-
-
0001257236
-
-
C. H. Yu, D. J. Kouri, M. Zhao, D. G. Truhlar, and D. W. Schwenke, Chem. Phys. Lett. 157, 491 (1989)
-
(1989)
Chem. Phys. Lett.
, vol.157
, pp. 491
-
-
Yu, C.H.1
Kouri, D.J.2
Zhao, M.3
Truhlar, D.G.4
Schwenke, D.W.5
-
60
-
-
0344178088
-
-
S. L. Mielke, D. W. Schwenke, S. C. Tucker, R. Steckler, F. B. Brown, G. C. Lynch, and D. G. Truhlar, J. Chem. Phys. 90, 3110 (1989)
-
(1989)
J. Chem. Phys.
, vol.90
, pp. 3110
-
-
Mielke, S.L.1
Schwenke, D.W.2
Tucker, S.C.3
Steckler, R.4
Brown, F.B.5
Lynch, G.C.6
Truhlar, D.G.7
-
61
-
-
35948999360
-
-
G. C. Lynch, R. Steckler, D. W. Schwenke, A. J. C. Varandas, D. G. Truhlar, and B. C. Garrett, ibid. 94, 7136 (1991)
-
(1991)
J. Chem. Phys.
, vol.94
, pp. 7136
-
-
Lynch, G.C.1
Steckler, R.2
Schwenke, D.W.3
Varandas, A.J.C.4
Truhlar, D.G.5
Garrett, B.C.6
-
62
-
-
0002070504
-
-
S. L. Mielke, G. C. Lynch, D. G. Truhlar, and D. W. Schwenke, Chem. Phys. Lett. 213, 10 (1993)
-
(1993)
Chem. Phys. Lett.
, vol.213
, pp. 10
-
-
Mielke, S.L.1
Lynch, G.C.2
Truhlar, D.G.3
Schwenke, D.W.4
-
63
-
-
23544463505
-
-
S. L. Mielke, G. C. Lynch, D. G. Truhlar, and D. W. Schwenke, Chem. Phys. Lett. 217, 387(E) (1994)
-
(1994)
Chem. Phys. Lett.
, vol.217
-
-
Mielke, S.L.1
Lynch, G.C.2
Truhlar, D.G.3
Schwenke, D.W.4
-
64
-
-
0033578767
-
-
H. Zhang, B. Ramachandran, J. Senekowitsch, and R. E. Wyatt, J. Mol. Struct.: THEOCHEM 487, 75 (1999).
-
(1999)
J. Mol. Struct.: THEOCHEM
, vol.487
, pp. 75
-
-
Zhang, H.1
Ramachandran, B.2
Senekowitsch, J.3
Wyatt, R.E.4
-
65
-
-
0003392735
-
-
NSRDS-NBS 35, Office of Standard Reference Data, National Bureau of Standards (U.S. GPO, Washington, D.C.)
-
C. E. Moore, Atomic Energy Levels, NSRDS-NBS 35, Office of Standard Reference Data, National Bureau of Standards (U.S. GPO, Washington, D.C., 1971).
-
(1971)
Atomic Energy Levels
-
-
Moore, C.E.1
-
66
-
-
0001126914
-
-
N. C. Handy, J. A. Pople, M. Head-Gordon, K. Raghavachari, and G. W. Trucks, Chem. Phys. Lett. 164, 185 (1989).
-
(1989)
Chem. Phys. Lett.
, vol.164
, pp. 185
-
-
Handy, N.C.1
Pople, J.A.2
Head-Gordon, M.3
Raghavachari, K.4
Trucks, G.W.5
-
77
-
-
0004161838
-
-
(Cambridge University Press, Cambridge, England)
-
W. H. Press, S. A. Teukolsky, W. T. Vetterling, and B. P. Flannery, Numerical Recipes in Fortran, 2nd ed. (Cambridge University Press, Cambridge, England, 1992), p. 51.
-
(1992)
Numerical Recipes in Fortran, 2nd Ed.
, pp. 51
-
-
Press, W.H.1
Teukolsky, S.A.2
Vetterling, W.T.3
Flannery, B.P.4
-
78
-
-
0036573314
-
-
T. Xie, D. Wang, J. M. Bowman, and D. E. Manolopoulos, J. Chem. Phys. 116, 7461 (2002).
-
(2002)
J. Chem. Phys.
, vol.116
, pp. 7461
-
-
Xie, T.1
Wang, D.2
Bowman, J.M.3
Manolopoulos, D.E.4
-
80
-
-
0001360843
-
-
P. L. Fast, J. C. Corchado, M. L. Sanchez, and D. G. Truhlar, J. Phys. Chem. A 103, 5129 (1999).
-
(1999)
J. Phys. Chem. A
, vol.103
, pp. 5129
-
-
Fast, P.L.1
Corchado, J.C.2
Sanchez, M.L.3
Truhlar, D.G.4
-
84
-
-
5244334815
-
-
T.-S. Ho, T. Hollebeek, H. Rabitz, L. B. Harding, and G. C. Schatz, J. Chem. Phys. 105, 10 472 (1996)
-
(1996)
J. Chem. Phys.
, vol.105
, pp. 10472
-
-
Ho, T.-S.1
Hollebeek, T.2
Rabitz, H.3
Harding, L.B.4
Schatz, G.C.5
-
85
-
-
0000985004
-
-
G. C. Schatz, A. Papaioannou, L. A. Pederson, L. B. Harding, T. Hollebeek, T.-S. Ho, and H. Rabitz, ibid. 107, 2340 (1997).
-
(1997)
J. Chem. Phys.
, vol.107
, pp. 2340
-
-
Schatz, G.C.1
Papaioannou, A.2
Pederson, L.A.3
Harding, L.B.4
Hollebeek, T.5
Ho, T.-S.6
Rabitz, H.7
-
86
-
-
0035281103
-
-
T. Hollebeek, T.-S. Ho, H. Rabitz, and L. B. Harding, J. Chem. Phys. 114, 3945 (2001).
-
(2001)
J. Chem. Phys.
, vol.114
, pp. 3945
-
-
Hollebeek, T.1
Ho, T.-S.2
Rabitz, H.3
Harding, L.B.4
-
87
-
-
0037040785
-
-
T.-S. Ho, T. Hollebeek, H. Rabitz, S. D. Chao, R. T. Skodje, A. S. Zyubin, and A. M. Mebel, J. Chem. Phys. 116, 4124 (2002).
-
(2002)
J. Chem. Phys.
, vol.116
, pp. 4124
-
-
Ho, T.-S.1
Hollebeek, T.2
Rabitz, H.3
Chao, S.D.4
Skodje, R.T.5
Zyubin, A.S.6
Mebel, A.M.7
|