-
7
-
-
0024919213
-
-
T. J. Wallington, J. M. Andino, E. W. Kaiser, and S. M. Japar, Int. J. Chem. Kinet. 21, 1113 (1989).
-
(1989)
Int. J. Chem. Kinet.
, vol.21
, pp. 1113
-
-
Wallington, T.J.1
Andino, J.M.2
Kaiser, E.W.3
Japar, S.M.4
-
12
-
-
33751553064
-
-
A. F. Wagner, I. R. Slagle, D. Sarzynski, and D. Gutman, J. Phys. Chem. 94, 1853 (1990).
-
(1990)
J. Phys. Chem.
, vol.94
, pp. 1853
-
-
Wagner, A.F.1
Slagle, I.R.2
Sarzynski, D.3
Gutman, D.4
-
15
-
-
0001647317
-
-
G. E. Quelch, M. M. Gallo, M. Shen, Y. Xie, H. F. Schaefer, and D. Moncrieff, J. Am. Chem. Soc. 116, 4953 (1994).
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 4953
-
-
Quelch, G.E.1
Gallo, M.M.2
Shen, M.3
Xie, Y.4
Schaefer, H.F.5
Moncrieff, D.6
-
27
-
-
0000109748
-
-
(i) L. A. Curtiss, K. Raghavachari, P. C. Redfern, and J. A. Pople, J. Chem. Phys. 106, 1063 (1997).
-
(1997)
J. Chem. Phys.
, vol.106
, pp. 1063
-
-
Curtiss, L.A.1
Raghavachari, K.2
Redfern, P.C.3
Pople, J.A.4
-
28
-
-
84887525551
-
-
Gaussian, Inc., Pittsburgh, PA
-
(a) GAUSSIAN 92/DFT, Revision F.2, M. J. Frisch, G. W. Trucks, H. B. Schlegel, P. M. W. Gill, B. G. Johnson, M. W. Wong, J. B. Foresman, M. A. Robb, M. Head-Gordon, E. S. Replogle, R. Gomperts, J. L. Andres, K. Raghavachari, J. S. Binkley, C. Gonzalez, R. L. Martin, D. J. Fox, D. J. Defrees, J. Baker, J. J. P. Stewart, and J. A. Pople, Gaussian, Inc., Pittsburgh, PA, 1993;
-
(1993)
GAUSSIAN 92/DFT, Revision F.2
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Wong, M.W.6
Foresman, J.B.7
Robb, M.A.8
Head-Gordon, M.9
Replogle, E.S.10
Gomperts, R.11
Andres, J.L.12
Raghavachari, K.13
Binkley, J.S.14
Gonzalez, C.15
Martin, R.L.16
Fox, D.J.17
Defrees, D.J.18
Baker, J.19
Stewart, J.J.P.20
Pople, J.A.21
more..
-
29
-
-
0010922186
-
-
Gaussian, Inc., Pittsburgh, PA
-
(b) GAUSSIAN 94, Revision B.3, M. J. Frisch, G. W. Trucks, H. B. Schlegel, P. M. W. Gill, B. G. Johnson, M. A. Robb, J. R. Cheeseman, T. Keith, G. A. Petersson, J. A. Montgomery, K. Raghavachari, M. A. Al-Laham, V. G. Zakrzewski, J. V. Ortiz, J. B. Foresman, C. Y. Peng, P. Y. Ayala, W. Chen, 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-Gordon, C. Gonzalez, and J. A. Pople, Gaussian, Inc., Pittsburgh, PA, 1995.
-
(1995)
GAUSSIAN 94, Revision B.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.8
Petersson, G.A.9
Montgomery, J.A.10
Raghavachari, 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
Chen, W.18
Wong, M.W.19
Andres, J.L.20
Replogle, E.S.21
Gomperts, R.22
Martin, R.L.23
Fox, D.J.24
Binkley, J.S.25
Defrees, D.J.26
Baker, J.27
Stewart, J.P.28
Head-Gordon, M.29
Gonzalez, C.30
Pople, J.A.31
more..
-
30
-
-
36849140788
-
-
S. Huzinaga, J. Chem. Phys. 42, 1293 (1965); T. H. Dunning, Jr., J. Chem. Phys. 53, 2823 (1970); T. H. Dunning, Jr. and P. J. Hay, in Modern Theoretical Chemistry, edited by H. F. Schaefer, (Plenum, New York, 1977), Vol. 3, pp. 1-27.
-
(1965)
J. Chem. Phys.
, vol.42
, pp. 1293
-
-
Huzinaga, S.1
-
31
-
-
28944448300
-
-
S. Huzinaga, J. Chem. Phys. 42, 1293 (1965); T. H. Dunning, Jr., J. Chem. Phys. 53, 2823 (1970); T. H. Dunning, Jr. and P. J. Hay, in Modern Theoretical Chemistry, edited by H. F. Schaefer, (Plenum, New York, 1977), Vol. 3, pp. 1-27.
-
(1970)
J. Chem. Phys.
, vol.53
, pp. 2823
-
-
Dunning Jr., T.H.1
-
32
-
-
36849140788
-
-
edited by H. F. Schaefer, Plenum, New York
-
S. Huzinaga, J. Chem. Phys. 42, 1293 (1965); T. H. Dunning, Jr., J. Chem. Phys. 53, 2823 (1970); T. H. Dunning, Jr. and P. J. Hay, in Modern Theoretical Chemistry, edited by H. F. Schaefer, (Plenum, New York, 1977), Vol. 3, pp. 1-27.
-
(1977)
Modern Theoretical Chemistry
, vol.3
, pp. 1-27
-
-
Dunning Jr., T.H.1
Hay, P.J.2
-
41
-
-
0344383379
-
-
E. D. Simandiras, J. E. Rice, R. D. Amos, and N. Handy, J. Chem. Phys. 88, 3187 (1988).
-
(1988)
J. Chem. Phys.
, vol.88
, pp. 3187
-
-
Simandiras, E.D.1
Rice, J.E.2
Amos, R.D.3
Handy, N.4
-
43
-
-
85033172259
-
-
private communication
-
P. Westmoreland (private communication).
-
-
-
Westmoreland, P.1
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