-
2
-
-
0002144317
-
-
Langmuir, I., 1919, J. Amer. chem. Soc, 41, 868
-
Lewis, G. N., 1916. J. Amer. chem. Soc, 38:762 Langmuir, I., 1919, J. Amer. chem. Soc, 41, 868
-
(1916)
J. Amer. chem. Soc
, vol.38
, pp. 762
-
-
Lewis, G.N.1
-
3
-
-
0011965942
-
-
Pietro, W. J., Francl, M. M., Hehre, W. J., DeFrees, D. J., Pople, J. A., and Binkley, J. S., 1982. J. Amer. chem. Soc, 104:5039
-
(1982)
J. Amer. chem. Soc
, vol.104
, pp. 5039
-
-
Pietro, W.J.1
Francl, M.M.2
Hehre, W.J.3
DeFrees, D.J.4
Pople, J.A.5
Binkley, J.S.6
-
9
-
-
4043165690
-
-
Thomas, J. R., DeLeeuw, B. J., Vacek, G., and Schaefer, H. F., 1993. J. chem. Phys., 98:1336
-
(1993)
J. chem. Phys.
, vol.98
, pp. 1336
-
-
Thomas, J.R.1
DeLeeuw, B.J.2
Vacek, G.3
Schaefer, H.F.4
-
10
-
-
0003469528
-
-
as cited in Lias, S. G., Bartness, J. E., Liebman, J. F., Holmes, J. L., Levin, R. D., and Mallard, W. G., 1988, Gas-Phase Ion and Neutral Thermochemistry (J.phys. chem. Ref. Data, Suppl. 1, 17)
-
Dudlin, A. V., Gorokhov, L. N., and Balaev, A. V., 1979. Izv. Akad. Nauk SSSR, Ser. Khim.,:2408 as cited in Lias, S. G., Bartness, J. E., Liebman, J. F., Holmes, J. L., Levin, R. D., and Mallard, W. G., 1988, Gas-Phase Ion and Neutral Thermochemistry (J.phys. chem. Ref. Data, Suppl. 1, 17)
-
(1979)
Izv. Akad. Nauk SSSR, Ser. Khim.
, pp. 2408
-
-
Dudlin, A.V.1
Gorokhov, L.N.2
Balaev, A.V.3
-
12
-
-
0002263655
-
-
Illenberger, T., Scheunemann, H., and Baumgartel, H., 1979. Chem. Phys., 37:21
-
(1979)
Chem. Phys.
, vol.37
, pp. 21
-
-
Illenberger, T.1
Scheunemann, H.2
Baumgartel, H.3
-
13
-
-
24844471877
-
-
as cited in Lias, S. G., Bartness, J. E., Liebman, J. F., Holmes, J. L., Levin, R. D., and Mallard, W. G., 1988, Gas-Phase Ion and Neutral Thermochemistry (J.phys. chem. Ref. Data, Suppl. 1, 17)
-
Balaev, A. V., Nikitin, I. M., Fedorova, L. I., and Rossolovskii, V. Y., 1980. Izv. Akad. Nauk SSSR, Ser. Khim.,:497 as cited in Lias, S. G., Bartness, J. E., Liebman, J. F., Holmes, J. L., Levin, R. D., and Mallard, W. G., 1988, Gas-Phase Ion and Neutral Thermochemistry (J.phys. chem. Ref. Data, Suppl. 1, 17)
-
(1980)
Izv. Akad. Nauk SSSR, Ser. Khim.
, pp. 497
-
-
Balaev, A.V.1
Nikitin, I.M.2
Fedorova, L.I.3
Rossolovskii, V.Y.4
-
18
-
-
2542551540
-
-
Galbraith, J. M., Vacek, G., and Schaefer, H. F., 1993. J. chem. Phys., 98:8051
-
(1993)
J. chem. Phys.
, vol.98
, pp. 8051
-
-
Galbraith, J.M.1
Vacek, G.2
Schaefer, H.F.3
-
22
-
-
37049140317
-
-
Breeze, A., Cruickshank, D. W. J., and Armstrong, D. R., 1972. J. chem. Soc. Faraday Trans, 68:2144
-
(1972)
J. chem. Soc. Faraday Trans
, vol.68
, pp. 2144
-
-
Breeze, A.1
Cruickshank, D.W.J.2
Armstrong, D.R.3
-
24
-
-
37049136201
-
-
Guest, M. F., Hall, M. B., and Hillier, I. H., 1973. J. chem. Soc. Faraday Trans, 69:1829
-
(1973)
J. chem. Soc. Faraday Trans
, vol.69
, pp. 1829
-
-
Guest, M.F.1
Hall, M.B.2
Hillier, I.H.3
-
26
-
-
0346269831
-
-
Dekock, R. L., Jasperse, C. P., Dao, D. T., Bieda, J. H., and Liebman, J. F., 1983. J. Fluorine Chem., 22:575
-
(1983)
J. Fluorine Chem.
, vol.22
, pp. 575
-
-
Dekock, R.L.1
Jasperse, C.P.2
Dao, D.T.3
Bieda, J.H.4
Liebman, J.F.5
-
30
-
-
33845307371
-
-
Collins, J. B., Schleyer, P. V. R., Binkley, J. S., and Pople, J. A., 1976. J. chem. Phys., 64:5142
-
(1976)
J. chem. Phys.
, vol.64
, pp. 5142
-
-
Collins, J.B.1
Schleyer, P.V.R.2
Binkley, J.S.3
Pople, J.A.4
-
32
-
-
0011965942
-
-
Pietro, W. J., Francl, M. M., Hehre, W. J., DeFrees, D. J., Pople, J. A., and Binkley, J. S., 1982. J. Amer. chem. Soc, 104:5039
-
(1982)
J. Amer. chem. Soc
, vol.104
, pp. 5039
-
-
Pietro, W.J.1
Francl, M.M.2
Hehre, W.J.3
DeFrees, D.J.4
Pople, J.A.5
Binkley, J.S.6
-
34
-
-
0345135644
-
-
Baird, N. C., Kuhn, M., and Lauriston, T. M., 1989. Can. J. Chem., 67:1952
-
(1989)
Can. J. Chem.
, vol.67
, pp. 1952
-
-
Baird, N.C.1
Kuhn, M.2
Lauriston, T.M.3
-
35
-
-
0001491227
-
-
Peterson, L. G. M., Gropen, O., and Siegbahn, P. E. M., 1983. Molec. Phys., 48:871
-
(1983)
Molec. Phys.
, vol.48
, pp. 871
-
-
Peterson, L.G.M.1
Gropen, O.2
Siegbahn, P.E.M.3
-
38
-
-
33947094846
-
-
Gimarc, B. M., Liebman, J. F., and Kohn, M., 1978. J. Amer. chem. Soc, 100:2334
-
(1978)
J. Amer. chem. Soc
, vol.100
, pp. 2334
-
-
Gimarc, B.M.1
Liebman, J.F.2
Kohn, M.3
-
41
-
-
0000410506
-
-
Christe, K. O., Sawodny, W., and Guertin, J. P., 1967. Inorg. Chem., 6:1159
-
(1967)
Inorg. Chem.
, vol.6
, pp. 1159
-
-
Christe, K.O.1
Sawodny, W.2
Guertin, J.P.3
-
43
-
-
36849122406
-
-
Begun, G. M., Fletcher, W. H., and Smith, D. F., 1965. J. chem. Phys., 42:2236
-
(1965)
J. chem. Phys.
, vol.42
, pp. 2236
-
-
Begun, G.M.1
Fletcher, W.H.2
Smith, D.F.3
-
44
-
-
0001576697
-
-
Selig, H., Claasen, H. H., and Holloway, J. H., 1970. J. chem. Phys., 52:3517
-
(1970)
J. chem. Phys.
, vol.52
, pp. 3517
-
-
Selig, H.1
Claasen, H.H.2
Holloway, J.H.3
-
47
-
-
0011915122
-
-
Mamantov, G., Vickroy, D. G., Vasini, E. J., Maekawa, T., and Moulton, M. C., 1970. Inorg. nucl. Chem. Lett., 6:701
-
(1970)
Inorg. nucl. Chem. Lett.
, vol.6
, pp. 701
-
-
Mamantov, G.1
Vickroy, D.G.2
Vasini, E.J.3
Maekawa, T.4
Moulton, M.C.5
-
49
-
-
2542591245
-
-
Nishikida, K., Williams, F., Mamantov, G., and Smyrl, N., 1975. J. Amer. chem. Soc, 97:3526
-
(1975)
J. Amer. chem. Soc
, vol.97
, pp. 3526
-
-
Nishikida, K.1
Williams, F.2
Mamantov, G.3
Smyrl, N.4
-
50
-
-
24844448005
-
-
Boate, A. R., Morton, J. R., and Preston, K. F., 1975. Inorg. Chem., 14:3127
-
(1975)
Inorg. Chem.
, vol.14
, pp. 3127
-
-
Boate, A.R.1
Morton, J.R.2
Preston, K.F.3
-
51
-
-
2542604951
-
-
Boate, A. R., Morton, J. R., and Preston, K. F., 1976. J.phys. Chem., 80:2954
-
(1976)
J.phys. Chem.
, vol.80
, pp. 2954
-
-
Boate, A.R.1
Morton, J.R.2
Preston, K.F.3
-
52
-
-
0000199251
-
-
Christe, K. O., Wilson, W. W., Chirakal, R. V., Sanders, J. C. P., and Schrobilgen, G. J., 1990. Inorg. Chem., 29:3506
-
(1990)
Inorg. Chem.
, vol.29
, pp. 3506
-
-
Christe, K.O.1
Wilson, W.W.2
Chirakal, R.V.3
Sanders, J.C.P.4
Schrobilgen, G.J.5
-
53
-
-
0009061445
-
-
Adams, W. J., Thompson, H. B., and Bartell, L. S., 1970. J. chem. Phys., 53:4040
-
(1970)
J. chem. Phys.
, vol.53
, pp. 4040
-
-
Adams, W.J.1
Thompson, H.B.2
Bartell, L.S.3
-
54
-
-
0000826622
-
-
Christe, K. O., Curtis, E. C., and Dixon, D. A., 1993. J. Amer. chem. Soc, 115:1520
-
(1993)
J. Amer. chem. Soc
, vol.115
, pp. 1520
-
-
Christe, K.O.1
Curtis, E.C.2
Dixon, D.A.3
-
57
-
-
0000712790
-
-
Gill, P. M. W., Johnson, B. G., Pople, J. A., and Frisch, M. J., 1992. Chem. Phys. Lett., 197:499
-
(1992)
Chem. Phys. Lett.
, vol.197
, pp. 499
-
-
Gill, P.M.W.1
Johnson, B.G.2
Pople, J.A.3
Frisch, M.J.4
-
58
-
-
84887525551
-
-
Pittsburg, PA: Gaussian, Inc
-
Frisch, M. J., Trucks, G. W., Schlegel, H. B., Gill, P. M. W., Johnson, B. G., Wong, M. W., Foresman, J. B., Robb, M. A., Head-Gordon, M., Replogle, E. S., Gomperts, R., Andres, J. L., Raghavachari, K., Binkley, J. S., Gonzalez, C., Martin, R. L., Fox, D. J., Defrees, D. J., Baker, J., Stewart, J. J. P., and Pople, J. A., 1993. Gaussian92/DFT, Revision F.2, Pittsburg, PA:Gaussian, Inc.
-
(1993)
Gaussian92/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..
-
61
-
-
0345491105
-
-
Lee, C., Yang, W., and Parr, R. G., 1988. Phys. Rev. B, 37:785
-
(1988)
Phys. Rev. B
, vol.37
, pp. 785
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
62
-
-
5944261746
-
-
34, 7046
-
Perdew, J. P., 1986. Phys. Rev. B, 33:8822 34, 7046
-
(1986)
Phys. Rev. B
, vol.33
, pp. 8822
-
-
Perdew, J.P.1
-
63
-
-
36849140788
-
-
Dunning, T. H., 1970, J. chem. Phys., 53, 2823; Huzinaga, S., 1971, Approximate Atomic Wavefunctions, Vol. II (Department of Chemistry, University of Alberta); Dunning, T. H., and Hay, P. J., 1977, Modern Theoretical Chemistry, edited by H. F. Schaefer (New York: Plenum Press), pp. 1–27
-
Huzinaga, S., 1965. J. chem. Phys., 42:1293 Dunning, T. H., 1970, J. chem. Phys., 53, 2823; Huzinaga, S., 1971, Approximate Atomic Wavefunctions, Vol. II (Department of Chemistry, University of Alberta); Dunning, T. H., and Hay, P. J., 1977, Modern Theoretical Chemistry, edited by H. F. Schaefer (New York:Plenum Press), pp. 1–27
-
(1965)
J. chem. Phys.
, vol.42
, pp. 1293
-
-
Huzinaga, S.1
-
65
-
-
0030123812
-
-
King, R. A., Galbraith, J. M., and Schaefer, H. F., 1996. J.phys. Chem., 100:6061
-
(1996)
J.phys. Chem.
, vol.100
, pp. 6061
-
-
King, R.A.1
Galbraith, J.M.2
Schaefer, H.F.3
-
66
-
-
0041432838
-
-
Ball, E. E., Ratner, M. A., and Sabin, J. R., 1977. Chem. Scr., 12:128
-
(1977)
Chem. Scr.
, vol.12
, pp. 128
-
-
Ball, E.E.1
Ratner, M.A.2
Sabin, J.R.3
-
67
-
-
36549094943
-
-
Pople, J. A., Head-Gordon, M., Fox, J., Raghavachari, K., and Curtiss, L. A., 1989. J. chem. Phys., 90:5622
-
(1989)
J. chem. Phys.
, vol.90
, pp. 5622
-
-
Pople, J.A.1
Head-Gordon, M.2
Fox, J.3
Raghavachari, K.4
Curtiss, L.A.5
-
69
-
-
0001541367
-
-
Blondel, C., Cacciani, P., Delsart, C., and Trainham, R., 1989. Phys. Rev. A., 40:3698
-
(1989)
Phys. Rev. A.
, vol.40
, pp. 3698
-
-
Blondel, C.1
Cacciani, P.2
Delsart, C.3
Trainham, R.4
-
71
-
-
26644436036
-
-
Tschumper, G. S., Fermann, J. T., and Schaefer, H. F., 1996. J. chem. Phys., 104:3676
-
(1996)
J. chem. Phys.
, vol.104
, pp. 3676
-
-
Tschumper, G.S.1
Fermann, J.T.2
Schaefer, H.F.3
|