-
1
-
-
0001321281
-
-
ed. R. J. H. Clark and R. E. Hester, Heyden, London
-
D. E. Irish and M. H. Brooker, in Advances in Infrared and Roman Spectroscopy, ed. R. J. H. Clark and R. E. Hester, Heyden, London, 1976, vol. 2, p. 212.
-
(1976)
Advances in Infrared and Roman Spectroscopy
, vol.2
, pp. 212
-
-
Irish, D.E.1
Brooker, M.H.2
-
2
-
-
0000351975
-
-
ed. R. R. Dogonadze, E. Kalman, A. A. Kornyshev and J. Ulstrup, Elsevier, Netherland
-
M. H. Brooker, in The Chemical Physics of Solvation, Part B. Spectroscopy of Solvation, ed. R. R. Dogonadze, E. Kalman, A. A. Kornyshev and J. Ulstrup, Elsevier, Netherlands, 1986, p.119.
-
(1986)
The Chemical Physics of Solvation, Part B. Spectroscopy of Solvation
, pp. 119
-
-
Brooker, M.H.1
-
3
-
-
0009531183
-
-
ed. E. D. Schmidt, Hans-Ferdinand Schulz Verlag, Freiburg, Germany, 2-8 September
-
M. Moskovits, Proc. Fifth Int. Conf. Roman Spectrosc., ed. E. D. Schmidt, Hans-Ferdinand Schulz Verlag, Freiburg, Germany, 2-8 September 1976, p. 768.
-
(1976)
Proc. Fifth Int. Conf. Roman Spectrosc.
, pp. 768
-
-
Moskovits, M.1
-
5
-
-
0009499671
-
-
C. P. Nash, T. C. Donnelly and P. A. Rock, J. Sol. Chem., 1977, 6, 663.
-
(1977)
J. Sol. Chem.
, vol.6
, pp. 663
-
-
Nash, C.P.1
Donnelly, T.C.2
Rock, P.A.3
-
6
-
-
0001430536
-
-
J. T. Bulmer, D. E. Irish and L. Oedberg, Can. J. Chem., 1975, 53, 3806.
-
(1975)
Can. J. Chem.
, vol.53
, pp. 3806
-
-
Bulmer, J.T.1
Irish, D.E.2
Oedberg, L.3
-
8
-
-
84986794835
-
-
F. Rull, Ch. Balarev, J. L. Alvarez, F. Sobron and A. Rodriguez, J. Raman Spectrosc., 1994, 25, 933.
-
(1994)
J. Raman Spectrosc.
, vol.25
, pp. 933
-
-
Rull, F.1
Balarev, Ch.2
Alvarez, J.L.3
Sobron, F.4
Rodriguez, A.5
-
10
-
-
36849112878
-
-
G. E. Walrafen, J. Chem. Phys., 1962, 36, 1035 and 1966, 44, 1546.
-
(1966)
J. Chem. Phys.
, vol.44
, pp. 1546
-
-
-
11
-
-
0343786464
-
-
W. W. Rudolph, M. H. Brooker and C. C. Pye, J. Phys. Chem., 1995, 99, 3793.
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 3793
-
-
Rudolph, W.W.1
Brooker, M.H.2
Pye, C.C.3
-
12
-
-
0001470064
-
-
C. C. Pye, W. Rudolph and R. A. Poirier, J. Phys. Chem., 1996, 100, 601.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 601
-
-
Pye, C.C.1
Rudolph, W.2
Poirier, R.A.3
-
13
-
-
84986754976
-
-
M. H. Brooker, O. Faurskov Nielsen and E. Praestgaard, J. Roman Spectrosc., 1988, 19, 71.
-
(1988)
J. Roman Spectrosc.
, vol.19
, pp. 71
-
-
Brooker, M.H.1
Faurskov Nielsen, O.2
Praestgaard, E.3
-
14
-
-
0030982381
-
-
M. Hartmann, T. Clark and R. van Eldik, J. Am. Chem. Soc., 1997, 119, 7843.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 7843
-
-
Hartmann, M.1
Clark, T.2
Van Eldik, R.3
-
16
-
-
0000801128
-
-
W. W. Rudolph, M. H. Brooker and P. R. Tremaine, Z. Phys. Chem., 1999, 209, 181.
-
(1999)
Z. Phys. Chem.
, vol.209
, pp. 181
-
-
Rudolph, W.W.1
Brooker, M.H.2
Tremaine, P.R.3
-
19
-
-
0000296594
-
-
W. W. Rudolph, M. H. Brooker and P. R. Tremaine, J. Solution Chem., 1997, 26, 757.
-
(1997)
J. Solution Chem.
, vol.26
, pp. 757
-
-
Rudolph, W.W.1
Brooker, M.H.2
Tremaine, P.R.3
-
20
-
-
11744283687
-
-
(a) W. J. Hehre, R. F. Stewart and J. A. Pople, J. Chem. Phys., 1969, 51, 2657
-
(1969)
J. Chem. Phys.
, vol.51
, pp. 2657
-
-
Hehre, W.J.1
Stewart, R.F.2
Pople, J.A.3
-
22
-
-
2442617487
-
-
(a)J. S. Binkley, J. A. Pople and W. J. Hehre, J. Am. Chem. Soc., 1980, 102, 939
-
(1980)
J. Am. Chem. Soc.
, vol.102
, pp. 939
-
-
Binkley, J.S.1
Pople, J.A.2
Hehre, W.J.3
-
24
-
-
0347170005
-
-
W. J. Hehre, R. Ditchfield and J. A. Pople, J. Chem. Phys., 1972, 56, 2257.
-
(1972)
J. Chem. Phys.
, vol.56
, pp. 2257
-
-
Hehre, W.J.1
Ditchfield, R.2
Pople, J.A.3
-
26
-
-
0009465498
-
-
Chemistry Department, Memorial University of Newfoundland, St. John's, Newfoundland
-
R. A. Poirier, M. R. Peterson and A. Yadav, MUNGAUSS, Chemistry Department, Memorial University of Newfoundland, St. John's, Newfoundland.
-
MUNGAUSS
-
-
Poirier, R.A.1
Peterson, M.R.2
Yadav, A.3
-
27
-
-
0009463773
-
-
Technical Memos 303 and 306, Applied Mathematics Division, Argonne National Laboratories, Argonne, IL, 1977. The algorithm is described in: W. C. Davidon
-
W. C. Davidon and L. Nazareth, Technical Memos 303 and 306, Applied Mathematics Division, Argonne National Laboratories, Argonne, IL, 1977. The algorithm is described in: W. C. Davidon, Math. Prog., 1975, 9, 1.
-
(1975)
Math. Prog.
, vol.9
, pp. 1
-
-
Davidon, W.C.1
Nazareth, L.2
-
29
-
-
84893169025
-
-
GAMESS, Iowa State University, Version of 17 July 1993
-
M. W. Schmidt, K. K. Baldridge, J. A. Boatz, S. T. Elbert, M. S. Gordon, J. H. Jensen, S. Koseki, N. Matsunaga, K. A. Nguyen, S. J. Su, T. L. Windus, M. Dupuis and J. A. Montgomery, GAMESS, Iowa State University, Version of 17 July 1993, J. Comput. Chem., 1993, 14, 1347.
-
(1993)
J. Comput. Chem.
, vol.14
, pp. 1347
-
-
Schmidt, M.W.1
Baldridge, K.K.2
Boatz, J.A.3
Elbert, S.T.4
Gordon, M.S.5
Jensen, J.H.6
Koseki, S.7
Matsunaga, N.8
Nguyen, K.A.9
Su, S.J.10
Windus, T.L.11
Dupuis, M.12
Montgomery, J.A.13
-
30
-
-
0004133516
-
-
Gaussian, Inc., Pittsburgh, PA
-
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 92/DFT, Revision F.4, Gaussian, Inc., Pittsburgh, PA, 1993.
-
(1993)
GAUSSIAN 92/DFT, Revision F.4
-
-
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..
-
34
-
-
0009498621
-
-
T. E. Jenkins and J. Lewis, Spectrochim. Acta, Part A, 1981, 37, 47.
-
(1981)
Spectrochim. Acta, Part A
, vol.37
, pp. 47
-
-
Jenkins, T.E.1
Lewis, J.2
-
39
-
-
4243251013
-
-
ed. S. Petrucci, Academic Press, New York, ch. 7
-
S. Petrucci, in Ionic Interactions, ed. S. Petrucci, Academic Press, New York, 1971 vol. II, ch. 7, p. 39ff.
-
(1971)
Ionic Interactions
, vol.2
-
-
Petrucci, S.1
-
41
-
-
11644292277
-
-
(b) E. S. Marcos, J. M. Martinez and R. R. Pappalardo, J. Chem. Phys., 1996, 105, 5968.
-
(1996)
J. Chem. Phys.
, vol.105
, pp. 5968
-
-
Marcos, E.S.1
Martinez, J.M.2
Pappalardo, R.R.3
-
42
-
-
14544302241
-
-
S. Lee, J. K. Kim, J. K. Park and K. S. Kim, J. Phys. Chem., 1996, 100, 14329.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 14329
-
-
Lee, S.1
Kim, J.K.2
Park, J.K.3
Kim, K.S.4
-
43
-
-
2142859139
-
-
A. K. Katz, J. P. Glusker, S. A. Beebe and Ch. W. Bock, J. Am. Chem. Soc., 1996, 118, 5752.
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 5752
-
-
Katz, A.K.1
Glusker, J.P.2
Beebe, S.A.3
Bock, Ch.W.4
-
44
-
-
0001520446
-
-
N. Ohtomo, K. Arakawa, M. Takeuchi, T. Yamaguchi and H. Ohtaki, Bull. Chem. Soc. Jpn., 1981, 54, 1314; cf. also Y. Marcus, Chem. Rev., 1988, 88, 1475.
-
(1981)
Bull. Chem. Soc. Jpn.
, vol.54
, pp. 1314
-
-
Ohtomo, N.1
Arakawa, K.2
Takeuchi, M.3
Yamaguchi, T.4
Ohtaki, H.5
-
45
-
-
0347777541
-
-
N. Ohtomo, K. Arakawa, M. Takeuchi, T. Yamaguchi and H. Ohtaki, Bull. Chem. Soc. Jpn., 1981, 54, 1314; cf. also Y. Marcus, Chem. Rev., 1988, 88, 1475.
-
(1988)
Chem. Rev.
, vol.88
, pp. 1475
-
-
Marcus, Y.1
-
46
-
-
0009494149
-
-
(cf. p. 8697, Table 4.)
-
R. Akesson, L. G. M. Petterson, M. Sandström and U. Wahlgreen, J. Am. Chem. Soc., 1994, 116, 8693 (cf. p. 8697, Table 4.).
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 8693
-
-
Akesson, R.1
Petterson, L.G.M.2
Sandström, M.3
Wahlgreen, U.4
-
47
-
-
0031646313
-
-
M. Pavlov, P. E. M. Siegbahn and M. Sandström, J. Phys. Chem. A, 1998, 102, 219.
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 219
-
-
Pavlov, M.1
Siegbahn, P.E.M.2
Sandström, M.3
-
48
-
-
0001493330
-
-
A. Muñoz-Páez, R. R. Pappalardo and E. S. Marcos, J. Am. Chem. Soc., 1995, 117, 11710.
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 11710
-
-
Muñoz-Páez, A.1
Pappalardo, R.R.2
Marcos, E.S.3
-
50
-
-
36449009665
-
-
(b) D. Feller, E. D. Glendening, R. A. Kendall and K. A. Peterson, J. Chem. Phys., 1994, 100, 4981.
-
(1994)
J. Chem. Phys.
, vol.100
, pp. 4981
-
-
Feller, D.1
Glendening, E.D.2
Kendall, R.A.3
Peterson, K.A.4
-
52
-
-
0009464150
-
-
V. M. Tret'yak, V. I. Baranovskii, O. V. Sizova and G. V. Kozhevnikova, Zh. Strukh. Khim., 1978, 19, 594.
-
(1978)
Zh. Strukh. Khim.
, vol.19
, pp. 594
-
-
Tret'Yak, V.M.1
Baranovskii, V.I.2
Sizova, O.V.3
Kozhevnikova, G.V.4
-
56
-
-
0002238924
-
-
D. Strömberg, M. Sandström and U. Wahlgren, Chem. Phys. Lett., 1990, 172, 49.
-
(1990)
Chem. Phys. Lett.
, vol.172
, pp. 49
-
-
Strömberg, D.1
Sandström, M.2
Wahlgren, U.3
-
58
-
-
0001622409
-
-
E. S. Marcos, R. R. Pappalardo and D. Rinaldi, J. Phys. Chem., 1991, 95, 8928.
-
(1991)
J. Phys. Chem.
, vol.95
, pp. 8928
-
-
Marcos, E.S.1
Pappalardo, R.R.2
Rinaldi, D.3
-
61
-
-
0002279294
-
-
B. J. Mhin, S. Lee, S. J. Cho, K. Lee and K. S. Kim, Chem. Phys. Lett., 1992, 197, 77.
-
(1992)
Chem. Phys. Lett.
, vol.197
, pp. 77
-
-
Mhin, B.J.1
Lee, S.2
Cho, S.J.3
Lee, K.4
Kim, K.S.5
-
62
-
-
0000273178
-
-
R. Akesson, L. G. M. Petterson, M. Sandström, P. E. M. Siegbahn and U. Wahlgren, J. Phys. Chem., 1992, 92, 10773.
-
(1992)
J. Phys. Chem.
, vol.92
, pp. 10773
-
-
Akesson, R.1
Petterson, L.G.M.2
Sandström, M.3
Siegbahn, P.E.M.4
Wahlgren, U.5
-
64
-
-
0000609585
-
-
C. W. Bock, A. K. Katz and J. P. Glusker, J. Am. Chem. Soc., 1995, 117, 3754.
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 3754
-
-
Bock, C.W.1
Katz, A.K.2
Glusker, J.P.3
-
65
-
-
0009463775
-
-
O. G. Parchment, M. A. Vincent and I. H. Hillier, J. Phys. Chem., 1996, 100, 14329.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 14329
-
-
Parchment, O.G.1
Vincent, M.A.2
Hillier, I.H.3
-
66
-
-
0009526153
-
-
S. Lee, J. Kim, J. K. Park and K. S. Kim, J. Phys. Chem., 1996, 100, 9869.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 9869
-
-
Lee, S.1
Kim, J.2
Park, J.K.3
Kim, K.S.4
-
67
-
-
0000638649
-
-
R. Akesson, L. G. M. Pettersson, M. Sandström and U. Wahlgren, J. Am. Chem. Soc., 1994, 116, 8691.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 8691
-
-
Akesson, R.1
Pettersson, L.G.M.2
Sandström, M.3
Wahlgren, U.4
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