-
3
-
-
0028508202
-
-
A. Geers, J. Kappert, F. Temps, and J. W. Wiebrecht, J. Chem. Phys. 101, 3618 (1994).
-
(1994)
J. Chem. Phys.
, vol.101
, pp. 3618
-
-
Geers, A.1
Kappert, J.2
Temps, F.3
Wiebrecht, J.W.4
-
7
-
-
0000945956
-
-
A. Geers, J. Kappert, F. Temps, and T. J. Sears, J. Chem. Phys. 98, 4297 (1993).
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 4297
-
-
Geers, A.1
Kappert, J.2
Temps, F.3
Sears, T.J.4
-
12
-
-
0001980554
-
-
edited by I. Prigogine and S. A. Rice Wiley, New York.
-
H. Koppel, W. Domcke, and L. S. Cederbaum, Adv. Chem. Phys., Vol. 57, edited by I. Prigogine and S. A. Rice (Wiley, New York. 1984). pp. 59-246.
-
(1984)
Adv. Chem. Phys.
, vol.57
, pp. 59-246
-
-
Koppel, H.1
Domcke, W.2
Cederbaum, L.S.3
-
13
-
-
36149015468
-
-
W. Lichten, Phys. Rev. 131, 229 (1963); 139, A27 (1965) ; 164, 131 (1967); F. T. Smith, Phys. Rev. 179, 111 (1969); T. F. O'Malley, Adv. At. Mol. Phys. 7, 223 (1971); T. Pacher, L. S. Cederbaum, and H. Köppel, Adv. Chem. Phys. 84, 293 (1993).
-
(1963)
Phys. Rev.
, vol.131
, pp. 229
-
-
Lichten, W.1
-
14
-
-
36149015468
-
-
W. Lichten, Phys. Rev. 131, 229 (1963); 139, A27 (1965) ; 164, 131 (1967); F. T. Smith, Phys. Rev. 179, 111 (1969); T. F. O'Malley, Adv. At. Mol. Phys. 7, 223 (1971); T. Pacher, L. S. Cederbaum, and H. Köppel, Adv. Chem. Phys. 84, 293 (1993).
-
(1965)
Phys. Rev.
, vol.139
-
-
-
15
-
-
36049060923
-
-
W. Lichten, Phys. Rev. 131, 229 (1963); 139, A27 (1965) ; 164, 131 (1967); F. T. Smith, Phys. Rev. 179, 111 (1969); T. F. O'Malley, Adv. At. Mol. Phys. 7, 223 (1971); T. Pacher, L. S. Cederbaum, and H. Köppel, Adv. Chem. Phys. 84, 293 (1993).
-
(1967)
Phys. Rev.
, vol.164
, pp. 131
-
-
-
16
-
-
36049057679
-
-
W. Lichten, Phys. Rev. 131, 229 (1963); 139, A27 (1965) ; 164, 131 (1967); F. T. Smith, Phys. Rev. 179, 111 (1969); T. F. O'Malley, Adv. At. Mol. Phys. 7, 223 (1971); T. Pacher, L. S. Cederbaum, and H. Köppel, Adv. Chem. Phys. 84, 293 (1993).
-
(1969)
Phys. Rev.
, vol.179
, pp. 111
-
-
Smith, F.T.1
-
17
-
-
77956831986
-
-
W. Lichten, Phys. Rev. 131, 229 (1963); 139, A27 (1965) ; 164, 131 (1967); F. T. Smith, Phys. Rev. 179, 111 (1969); T. F. O'Malley, Adv. At. Mol. Phys. 7, 223 (1971); T. Pacher, L. S. Cederbaum, and H. Köppel, Adv. Chem. Phys. 84, 293 (1993).
-
(1971)
Adv. At. Mol. Phys.
, vol.7
, pp. 223
-
-
O'Malley, T.F.1
-
18
-
-
84858993709
-
-
W. Lichten, Phys. Rev. 131, 229 (1963); 139, A27 (1965) ; 164, 131 (1967); F. T. Smith, Phys. Rev. 179, 111 (1969); T. F. O'Malley, Adv. At. Mol. Phys. 7, 223 (1971); T. Pacher, L. S. Cederbaum, and H. Köppel, Adv. Chem. Phys. 84, 293 (1993).
-
(1993)
Adv. Chem. Phys.
, vol.84
, pp. 293
-
-
Pacher, T.1
Cederbaum, L.S.2
Köppel, H.3
-
23
-
-
85037502639
-
-
with contributions from J. Almlöf, R. D. Amos. M. J. O. Deegan, S. T. Elbert, C. Hampel, W. Meyer, K. A. Peterson, R. Pitzer, A. J. Stone, and P. R. Taylor
-
MOLPRO is a package of ab initio programs written by H.-J. Werner and P. J. Knowles, with contributions from J. Almlöf, R. D. Amos. M. J. O. Deegan, S. T. Elbert, C. Hampel, W. Meyer, K. A. Peterson, R. Pitzer, A. J. Stone, and P. R. Taylor.
-
-
-
Werner, H.-J.1
Knowles, P.J.2
-
26
-
-
24444434383
-
-
H.-J. Werner and P. J. Knowles, J. Chem. Phys. 89, 5803 (1988); P. J. Knowles and H.-J. Werner, J. Chem. Phys. 145, 514 (1988); H.-J. Werner and E. A. Reinsch, J. Chem. Phys. 76, 3144 (1982); H.-J. Werner, Adv. Chem. Phys. 59, 1 (1987).
-
(1988)
J. Chem. Phys.
, vol.89
, pp. 5803
-
-
Werner, H.-J.1
Knowles, P.J.2
-
27
-
-
11744301188
-
-
H.-J. Werner and P. J. Knowles, J. Chem. Phys. 89, 5803 (1988); P. J. Knowles and H.-J. Werner, J. Chem. Phys. 145, 514 (1988); H.-J. Werner and E. A. Reinsch, J. Chem. Phys. 76, 3144 (1982); H.-J. Werner, Adv. Chem. Phys. 59, 1 (1987).
-
(1988)
J. Chem. Phys.
, vol.145
, pp. 514
-
-
Knowles, P.J.1
Werner, H.-J.2
-
28
-
-
36749109134
-
-
H.-J. Werner and P. J. Knowles, J. Chem. Phys. 89, 5803 (1988); P. J. Knowles and H.-J. Werner, J. Chem. Phys. 145, 514 (1988); H.-J. Werner and E. A. Reinsch, J. Chem. Phys. 76, 3144 (1982); H.-J. Werner, Adv. Chem. Phys. 59, 1 (1987).
-
(1982)
J. Chem. Phys.
, vol.76
, pp. 3144
-
-
Werner, H.-J.1
Reinsch, E.A.2
-
29
-
-
24444434383
-
-
H.-J. Werner and P. J. Knowles, J. Chem. Phys. 89, 5803 (1988); P. J. Knowles and H.-J. Werner, J. Chem. Phys. 145, 514 (1988); H.-J. Werner and E. A. Reinsch, J. Chem. Phys. 76, 3144 (1982); H.-J. Werner, Adv. Chem. Phys. 59, 1 (1987).
-
(1987)
Adv. Chem. Phys.
, vol.59
, pp. 1
-
-
Werner, H.-J.1
-
31
-
-
0000215425
-
-
H.-J. Werner and W. Meyer, J. Chem. Phys. 74, 5794 (1981); 73, 2342 (1980).
-
(1980)
J. Chem. Phys.
, vol.73
, pp. 2342
-
-
-
32
-
-
0037780883
-
-
H.-J. Werner and P. J. Knowles, J. Chem. Phys. 82, 5053 (1985); P. J. Knowles and H.-J. Werner, Chem. Phys. Lett. 115, 259 (1985).
-
(1985)
J. Chem. Phys.
, vol.82
, pp. 5053
-
-
Werner, H.-J.1
Knowles, P.J.2
-
34
-
-
0003462314
-
-
Birkhauser, Boston
-
See, for example, J. K. Cullum and R. Willoughby, Lanczos Algorithms for Large Symmetric Eigenvalue Problems (Birkhauser, Boston, 1985), Vols. 1 and 2.
-
(1985)
Lanczos Algorithms for Large Symmetric Eigenvalue Problems
, vol.1-2
-
-
Cullum, J.K.1
Willoughby, R.2
-
37
-
-
0000507294
-
-
edited by Miller and Bondybey North-Holland, Amsterdam
-
T. A. Miller and V. E. Bondybey, in Molecular Ions: Spectroscopy, Structure and Chemistry, edited by Miller and Bondybey (North-Holland, Amsterdam, 1983), pp. 201-229.
-
(1983)
Molecular Ions: Spectroscopy, Structure and Chemistry
, pp. 201-229
-
-
Miller, T.A.1
Bondybey, V.E.2
-
38
-
-
0000316772
-
-
J. Eiding, R. Schneider, W. Domcke, H. Köppel, and W. von Niessen, Chem. Phys. Lett. 177, 345 (1991).
-
(1991)
Chem. Phys. Lett.
, vol.177
, pp. 345
-
-
Eiding, J.1
Schneider, R.2
Domcke, W.3
Köppel, H.4
Von Niessen, W.5
-
40
-
-
0041641312
-
-
X. Liu, C. P. Damo, T.-Y. D. Lin, S. C. Foster, P. Misra, L. Yu, and T. A. Miller, J. Phys. Chem. 93, 2266 (1989).
-
(1989)
J. Phys. Chem.
, vol.93
, pp. 2266
-
-
Liu, X.1
Damo, C.P.2
Lin, T.-Y.D.3
Foster, S.C.4
Misra, P.5
Yu, L.6
Miller, T.A.7
-
41
-
-
0000792569
-
-
T. Momose, Y. Endo, E. Hirota, and T. Shida, J. Chem. Phys. 88, 5338 (1988).
-
(1988)
J. Chem. Phys.
, vol.88
, pp. 5338
-
-
Momose, T.1
Endo, Y.2
Hirota, E.3
Shida, T.4
-
43
-
-
0042421504
-
-
Universität Göttingen
-
J. Kolewe, Diplomarbeit, Universität Göttingen 1995.
-
(1995)
Diplomarbeit
-
-
Kolewe, J.1
-
44
-
-
0000162947
-
-
182.
-
G. D. Bent, G. F. Adams, R. H. Bartram, G. D. Purvis, and R. J. Bartlett, J. Chem. Phys. 76, 4144 (182).
-
J. Chem. Phys.
, vol.76
, pp. 4144
-
-
Bent, G.D.1
Adams, G.F.2
Bartram, R.H.3
Purvis, G.D.4
Bartlett, R.J.5
-
45
-
-
0011308663
-
-
G. D. Bent and R. H. Bartram, Mol. Phys. 51, 1487 (1984); G. D. Bent, J. Chem. Phys. 89, 7298 (1988).
-
(1984)
Mol. Phys.
, vol.51
, pp. 1487
-
-
Bent, G.D.1
Bartram, R.H.2
-
46
-
-
0042421509
-
-
G. D. Bent and R. H. Bartram, Mol. Phys. 51, 1487 (1984); G. D. Bent, J. Chem. Phys. 89, 7298 (1988).
-
(1988)
J. Chem. Phys.
, vol.89
, pp. 7298
-
-
Bent, G.D.1
-
48
-
-
85037503663
-
-
Dorweth, Netherlands, F. Temps (private communication)
-
A. Geers, J. Kappert, C. Stöck, F. Temps, and J. W. Wiebrecht, 22nd International Symposium on Free Radicals, Paper B7 (Dorweth, Netherlands, 1993); F. Temps (private communication).
-
(1993)
22nd International Symposium on Free Radicals, Paper B7
-
-
Geers, A.1
Kappert, J.2
Stöck, C.3
Temps, F.4
Wiebrecht, J.W.5
-
50
-
-
33845185029
-
-
M. Page, M. C. Lin, Y. He, and T. K. Choudhury, J. Chem. Phys. 93, 4404 (1989).
-
(1989)
J. Chem. Phys.
, vol.93
, pp. 4404
-
-
Page, M.1
Lin, M.C.2
He, Y.3
Choudhury, T.K.4
-
51
-
-
0000358108
-
-
edited by S. Geschwind Plenum, New York
-
F. S. Ham, in Electron Paramagnetic Resonance, edited by S. Geschwind (Plenum, New York, 1972); F. S. Ham, Phys. Rev. 166, 307 (1968).
-
(1972)
Electron Paramagnetic Resonance
-
-
Ham, F.S.1
-
52
-
-
0000358108
-
-
F. S. Ham, in Electron Paramagnetic Resonance, edited by S. Geschwind (Plenum, New York, 1972); F. S. Ham, Phys. Rev. 166, 307 (1968).
-
(1968)
Phys. Rev.
, vol.166
, pp. 307
-
-
Ham, F.S.1
-
53
-
-
0000548965
-
-
B. R. Judd, J. Chem. Phys. 67, 1174 (1977); B. Halperin and R. Englman, Phys. Rev. Lett. 31, 1052 (1973).
-
(1977)
J. Chem. Phys.
, vol.67
, pp. 1174
-
-
Judd, B.R.1
-
55
-
-
0000001724
-
-
H. C. Longuet-Higgins, U. Öpik, M. H. L. Pryce, and R. A. Sack, Proc. R. Soc. London, Sci. A 244, 1 (1958).
-
(1958)
Proc. R. Soc. London, Sci. A
, vol.244
, pp. 1
-
-
Longuet-Higgins, H.C.1
Öpik, U.2
Pryce, M.H.L.3
Sack, R.A.4
-
57
-
-
0042922260
-
-
G. Herzberg and E. Teller, Z. Phys. Chem. Abt. B 21, 410 (1933); J. Brickmann, Mol. Phys. 35, 155 (1978).
-
(1978)
Mol. Phys.
, vol.35
, pp. 155
-
-
Brickmann, J.1
-
58
-
-
36849108033
-
-
M. H. Perrin and M. Gouterman, J. Chem. Phys. 46, 1019 (1967); J. H. van der Waals, A. M. D. Berghuis, and M. S. de Groot, Mol. Phys. 13, 301 (1967); P. J. Stephens, J. Chem. Phys. 51, 1995 (1969); M. Z. Zgierski and M. Pawlikowski, ibid. 70, 3444 (1979).
-
(1967)
J. Chem. Phys.
, vol.46
, pp. 1019
-
-
Perrin, M.H.1
Gouterman, M.2
-
59
-
-
84914085796
-
-
M. H. Perrin and M. Gouterman, J. Chem. Phys. 46, 1019 (1967); J. H. van der Waals, A. M. D. Berghuis, and M. S. de Groot, Mol. Phys. 13, 301 (1967); P. J. Stephens, J. Chem. Phys. 51, 1995 (1969); M. Z. Zgierski and M. Pawlikowski, ibid. 70, 3444 (1979).
-
(1967)
Mol. Phys.
, vol.13
, pp. 301
-
-
Van Der Waals, J.H.1
Berghuis, A.M.D.2
De Groot, M.S.3
-
60
-
-
0011402739
-
-
M. H. Perrin and M. Gouterman, J. Chem. Phys. 46, 1019 (1967); J. H. van der Waals, A. M. D. Berghuis, and M. S. de Groot, Mol. Phys. 13, 301 (1967); P. J. Stephens, J. Chem. Phys. 51, 1995 (1969); M. Z. Zgierski and M. Pawlikowski, ibid. 70, 3444 (1979).
-
(1969)
J. Chem. Phys.
, vol.51
, pp. 1995
-
-
Stephens, P.J.1
-
61
-
-
0001757308
-
-
M. H. Perrin and M. Gouterman, J. Chem. Phys. 46, 1019 (1967); J. H. van der Waals, A. M. D. Berghuis, and M. S. de Groot, Mol. Phys. 13, 301 (1967); P. J. Stephens, J. Chem. Phys. 51, 1995 (1969); M. Z. Zgierski and M. Pawlikowski, ibid. 70, 3444 (1979).
-
(1979)
J. Chem. Phys.
, vol.70
, pp. 3444
-
-
Zgierski, M.Z.1
Pawlikowski, M.2
-
66
-
-
0000383584
-
-
D. L Osborn, D. J. Leahy, E. H. Kim, E. de Beer, and D. M. Neumark, Chem. Phys. Lett. 292, 651 (1998); T. M. Ramond, G. E. Davico, R. L. Schwartz, and W. C. Lineberger, J. Chem. Phys. 112, 1158 (2000).
-
(1998)
Chem. Phys. Lett.
, vol.292
, pp. 651
-
-
Osborn, D.L.1
Leahy, D.J.2
Kim, E.H.3
De Beer, E.4
Neumark, D.M.5
-
67
-
-
0000336295
-
-
D. L Osborn, D. J. Leahy, E. H. Kim, E. de Beer, and D. M. Neumark, Chem. Phys. Lett. 292, 651 (1998); T. M. Ramond, G. E. Davico, R. L. Schwartz, and W. C. Lineberger, J. Chem. Phys. 112, 1158 (2000).
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 1158
-
-
Ramond, T.M.1
Davico, G.E.2
Schwartz, R.L.3
Lineberger, W.C.4
-
70
-
-
85037516217
-
-
unpublished
-
H. Köppel (unpublished).
-
-
-
Köppel, H.1
-
71
-
-
85037503871
-
-
Dissertation, Klaus Bielefeld Verlag, Friedland
-
U. Höper, Dissertation, Klaus Bielefeld Verlag, Friedland, 1997.
-
(1997)
-
-
Höper, U.1
|