-
4
-
-
2742592798
-
-
R. Gordon, J. Chem. Phys. 41, 1819 (1967); 43, 1307 (1965).
-
(1965)
J. Chem. Phys.
, vol.43
, pp. 1307
-
-
-
5
-
-
36849137373
-
-
R. Gordon, J. Chem. Phys. 40, 1973 (1964); 43, 1307 (1965).
-
(1964)
J. Chem. Phys.
, vol.40
, pp. 1973
-
-
Gordon, R.1
-
6
-
-
2742592798
-
-
R. Gordon, J. Chem. Phys. 40, 1973 (1964); 43, 1307 (1965).
-
(1965)
J. Chem. Phys.
, vol.43
, pp. 1307
-
-
-
10
-
-
85034478415
-
-
Ph.D. thesis, University of Illinois, Urbana
-
D. W. Noid, Ph.D. thesis, University of Illinois, Urbana, 1976.
-
(1976)
-
-
Noid, D.W.1
-
16
-
-
0011413749
-
-
S. Abbate, G. Longhi, L. Ricard, C. Bertucci, C. Rosini, P. Salvadori, and A. Moscowitz, J. Am. Chem. Soc. 111, 836 (1989).
-
(1989)
J. Am. Chem. Soc.
, vol.111
, pp. 836
-
-
Abbate, S.1
Longhi, G.2
Ricard, L.3
Bertucci, C.4
Rosini, C.5
Salvadori, P.6
Moscowitz, A.7
-
17
-
-
0030134013
-
-
S. Abbate, G. Longhi, J. W. Givens III, S. E. Boiadjiev, D. A. Lightner, and A. Moscowitz, Appl. Spectrosc. 50, 642 (1996).
-
(1996)
Appl. Spectrosc.
, vol.50
, pp. 642
-
-
Abbate, S.1
Longhi, G.2
Givens III, J.W.3
Boiadjiev, S.E.4
Lightner, D.A.5
Moscowitz, A.6
-
19
-
-
11344283966
-
-
Bochum, FRG
-
S. Abbate, G. Longhi, D. Cavagnat, L. Lespade, C. Bertucci, and P. Salvadori, Proceedings of the 4th Intl. Conference on CD, Bochum, FRG, 1991, p. 225.
-
(1991)
Proceedings of the 4th Intl. Conference on CD
, pp. 225
-
-
Abbate, S.1
Longhi, G.2
Cavagnat, D.3
Lespade, L.4
Bertucci, C.5
Salvadori, P.6
-
21
-
-
85034485470
-
-
The exponential in here is a consequence of the particular assumption of a Boltzmann distribution for the ensemble of initial states |I〉 [See Eq. (7) of Ref 1], as will be clearer later
-
The exponential in here is a consequence of the particular assumption of a Boltzmann distribution for the ensemble of initial states |I〉 [See Eq. (7) of Ref 1], as will be clearer later.
-
-
-
-
22
-
-
11344249115
-
-
Ph.D. thesis, Harvard University
-
A. Moscowitz, Ph.D. thesis, Harvard University, 1959; A. Moscowitz, Advances in Chemical Physics, edited by I. Prigogine Vol. IV, (Interscience, New York, 1962).
-
(1959)
-
-
Moscowitz, A.1
-
23
-
-
11344281053
-
-
edited by I. Prigogine Interscience, New York
-
A. Moscowitz, Ph.D. thesis, Harvard University, 1959; A. Moscowitz, Advances in Chemical Physics, edited by I. Prigogine Vol. IV, (Interscience, New York, 1962).
-
(1962)
Advances in Chemical Physics
, vol.4
-
-
Moscowitz, A.1
-
25
-
-
85034465510
-
-
note
-
iwt〈μ(0) · M(-t)〉. This equation can be easily seen to imply Eq. (13b) by making the change of variables t′ = -t.
-
-
-
-
27
-
-
0003589741
-
-
Springer, Berlin
-
(b) R. Kubo, M. Toda, N. Hashitsume, Statistical Physics II: Nonequilibrium Statistical Mechanics, 2nd ed. (Springer, Berlin, 1995).
-
(1995)
Statistical Physics II: Nonequilibrium Statistical Mechanics, 2nd Ed.
-
-
Kubo, R.1
Toda, M.2
Hashitsume, N.3
-
28
-
-
0038502535
-
-
C. W. Deutsche and A. Moscowitz, J. Chem. Phys. 49, 3257 (1968); C. W. Deutsche and A. Moscowitz, ibid. 53, 2630 (1970); J. Schellmann, ibid. 58, 2882 (1973); T. R. Faulkner, Ph.D. thesis, University of Minnesota, 1979.
-
(1968)
J. Chem. Phys.
, vol.49
, pp. 3257
-
-
Deutsche, C.W.1
Moscowitz, A.2
-
29
-
-
36849108310
-
-
C. W. Deutsche and A. Moscowitz, J. Chem. Phys. 49, 3257 (1968); C. W. Deutsche and A. Moscowitz, ibid. 53, 2630 (1970); J. Schellmann, ibid. 58, 2882 (1973); T. R. Faulkner, Ph.D. thesis, University of Minnesota, 1979.
-
(1970)
J. Chem. Phys.
, vol.53
, pp. 2630
-
-
Deutsche, C.W.1
Moscowitz, A.2
-
30
-
-
0347878699
-
-
C. W. Deutsche and A. Moscowitz, J. Chem. Phys. 49, 3257 (1968); C. W. Deutsche and A. Moscowitz, ibid. 53, 2630 (1970); J. Schellmann, ibid. 58, 2882 (1973); T. R. Faulkner, Ph.D. thesis, University of Minnesota, 1979.
-
(1973)
J. Chem. Phys.
, vol.58
, pp. 2882
-
-
Schellmann, J.1
-
31
-
-
0038502535
-
-
Ph.D. thesis, University of Minnesota
-
C. W. Deutsche and A. Moscowitz, J. Chem. Phys. 49, 3257 (1968); C. W. Deutsche and A. Moscowitz, ibid. 53, 2630 (1970); J. Schellmann, ibid. 58, 2882 (1973); T. R. Faulkner, Ph.D. thesis, University of Minnesota, 1979.
-
(1979)
-
-
Faulkner, T.R.1
-
32
-
-
0004003691
-
-
McGraw Hill, New York
-
E. B. Wilson, Jr., J. Decius, and P. C. Cross, Molecular Vibrations (McGraw Hill, New York, 1955).
-
(1955)
Molecular Vibrations
-
-
Wilson Jr., E.B.1
Decius, J.2
Cross, P.C.3
-
33
-
-
11344251789
-
-
G. Longhi, S. Abbate, C. Zagano, G. Botto, and L. Ricard Lespade, Theor. Chim. Acta 82, 32 (1992).
-
(1992)
Theor. Chim. Acta
, vol.82
, pp. 32
-
-
Longhi, G.1
Abbate, S.2
Zagano, C.3
Botto, G.4
Ricard Lespade, L.5
-
34
-
-
0011644205
-
-
S. Abbate, D. Ghisletti, A. Giorgilli, L. Lespade, and G. Longhi, Theor. Chim. Acta 87, 215 (1993).
-
(1993)
Theor. Chim. Acta
, vol.87
, pp. 215
-
-
Abbate, S.1
Ghisletti, D.2
Giorgilli, A.3
Lespade, L.4
Longhi, G.5
-
35
-
-
0000098804
-
-
C. Jaffé and P. Brumer, J. Chem. Phys. 73, 5646 (1980); E. L. Sibert, W. P. Reinhardt, and J. T. Hynes, ibid. 77, 3583 (1982).
-
(1980)
J. Chem. Phys.
, vol.73
, pp. 5646
-
-
Jaffé, C.1
Brumer, P.2
-
36
-
-
33645701610
-
-
C. Jaffé and P. Brumer, J. Chem. Phys. 73, 5646 (1980); E. L. Sibert, W. P. Reinhardt, and J. T. Hynes, ibid. 77, 3583 (1982).
-
(1982)
J. Chem. Phys.
, vol.77
, pp. 3583
-
-
Sibert, E.L.1
Reinhardt, W.P.2
Hynes, J.T.3
-
37
-
-
0000898226
-
-
E. L. Sibert, W. P. Reinhardt, and J. T. Hynes, J. Chem. Phys. 77, 3595 (1982); I. M. Mills and A. G. Robiette, Mol. Phys. 56, 743 (1985).
-
(1982)
J. Chem. Phys.
, vol.77
, pp. 3595
-
-
Sibert, E.L.1
Reinhardt, W.P.2
Hynes, J.T.3
-
38
-
-
0001511992
-
-
E. L. Sibert, W. P. Reinhardt, and J. T. Hynes, J. Chem. Phys. 77, 3595 (1982); I. M. Mills and A. G. Robiette, Mol. Phys. 56, 743 (1985).
-
(1985)
Mol. Phys.
, vol.56
, pp. 743
-
-
Mills, I.M.1
Robiette, A.G.2
-
39
-
-
0003474751
-
-
Cambridge University Press, Cambridge
-
17=131,072, in order to use the FFT routine most efficiently [see, e.g., W. H. Press, B. P. Flannery, S. A. Teukolsky, and W. T. Vetterling, Numerical Recipes (Cambridge University Press, Cambridge, 1990).
-
(1990)
Numerical Recipes
-
-
Press, W.H.1
Flannery, B.P.2
Teukolsky, S.A.3
Vetterling, W.T.4
-
40
-
-
85034481642
-
-
0-2χI, where I is the action of the oscillator (Refs. 26-29)
-
0-2χI, where I is the action of the oscillator (Refs. 26-29).
-
-
-
-
42
-
-
0011468873
-
-
edited by R. J. Clark and R. E. Hester Elsevier, Amsterdam, Chap. 4
-
B. R. Henry, in Advances in IR and Raman Spectroscopy, edited by R. J. Clark and R. E. Hester (Elsevier, Amsterdam, 1979), Vol. 10, Chap. 4, p. 269; M. S. Child and L. Halonen, Advances in Chemical Physics, edited by J. Jortner, L. V. Levine, and S. A. Rice, Vol. LVII (Wiley, New York, 1985), p. 1.
-
(1979)
Advances in IR and Raman Spectroscopy
, vol.10
, pp. 269
-
-
Henry, B.R.1
-
43
-
-
0002163931
-
-
edited by J. Jortner, L. V. Levine, and S. A. Rice, Wiley, New York
-
B. R. Henry, in Advances in IR and Raman Spectroscopy, edited by R. J. Clark and R. E. Hester (Elsevier, Amsterdam, 1979), Vol. 10, Chap. 4, p. 269; M. S. Child and L. Halonen, Advances in Chemical Physics, edited by J. Jortner, L. V. Levine, and S. A. Rice, Vol. LVII (Wiley, New York, 1985), p. 1.
-
(1985)
Advances in Chemical Physics
, vol.57
, pp. 1
-
-
Child, M.S.1
Halonen, L.2
-
47
-
-
11344251790
-
Comparison of power spectra with vibrational absorption spectra in the range 2000-1700 nm
-
International discussion meeting of the Deutsche Bunsengesellschaft fur Physikalische Chemie, Grainau, Germany
-
S. Abbate and G. Longhi "Comparison of power spectra with vibrational absorption spectra in the range 2000-1700 nm," International discussion meeting of the Deutsche Bunsengesellschaft fur Physikalische Chemie, "Molecular Spectroscopy and Molecular Dynamics," Grainau, Germany, 1994; S. Abbate, G. Longhi, K. Kwon, and A. Moscowitz, "Interpretation of near infrared Circular Dichroism Spectra through the Fourier cross-spectra of classical trajectories", 50th International Symposium of Molecular Spectroscopy, Columbus, Ohio, 1995.
-
(1994)
Molecular Spectroscopy and Molecular Dynamics
-
-
Abbate, S.1
Longhi, G.2
-
48
-
-
85034469788
-
Interpretation of near infrared Circular Dichroism Spectra through the Fourier cross-spectra of classical trajectories
-
Columbus, Ohio
-
S. Abbate and G. Longhi "Comparison of power spectra with vibrational absorption spectra in the range 2000-1700 nm," International discussion meeting of the Deutsche Bunsengesellschaft fur Physikalische Chemie, "Molecular Spectroscopy and Molecular Dynamics," Grainau, Germany, 1994; S. Abbate, G. Longhi, K. Kwon, and A. Moscowitz, "Interpretation of near infrared Circular Dichroism Spectra through the Fourier cross-spectra of classical trajectories", 50th International Symposium of Molecular Spectroscopy, Columbus, Ohio, 1995.
-
(1995)
50th International Symposium of Molecular Spectroscopy
-
-
Abbate, S.1
Longhi, G.2
Kwon, K.3
Moscowitz, A.4
-
51
-
-
0004222594
-
-
edited by J. R. Durig Elsevier, Amsterdam
-
L. A. Nafie, in Vibrational Spectra and Structure, Vol. 10, edited by J. R. Durig (Elsevier, Amsterdam, 1982); T. A. Keiderling, Appl. Spectrosc. Rev. 17, 189 (1981); P. J. Stephens, Annu. Rev. Phys. Chem. 27, 201 (1974).
-
(1982)
Vibrational Spectra and Structure
, vol.10
-
-
Nafie, L.A.1
-
52
-
-
0000153004
-
-
L. A. Nafie, in Vibrational Spectra and Structure, Vol. 10, edited by J. R. Durig (Elsevier, Amsterdam, 1982); T. A. Keiderling, Appl. Spectrosc. Rev. 17, 189 (1981); P. J. Stephens, Annu. Rev. Phys. Chem. 27, 201 (1974).
-
(1981)
Appl. Spectrosc. Rev.
, vol.17
, pp. 189
-
-
Keiderling, T.A.1
-
53
-
-
0001765497
-
-
L. A. Nafie, in Vibrational Spectra and Structure, Vol. 10, edited by J. R. Durig (Elsevier, Amsterdam, 1982); T. A. Keiderling, Appl. Spectrosc. Rev. 17, 189 (1981); P. J. Stephens, Annu. Rev. Phys. Chem. 27, 201 (1974).
-
(1974)
Annu. Rev. Phys. Chem.
, vol.27
, pp. 201
-
-
Stephens, P.J.1
|