-
2
-
-
0033518178
-
-
10.1038/44976
-
A. Nitzan, Nature (London) 402, 472 (1999). 10.1038/44976
-
(1999)
Nature (London)
, vol.402
, pp. 472
-
-
Nitzan, A.1
-
3
-
-
38649099685
-
-
10.1073/pnas.0705792105, Nature (London) 434, 199 (2005). 10.1038/nature03383
-
D. Kraemer, M. L Cowan, A. Paarman, N. Huse, E. T. J. Nibbering, T. Elsaesser, and R. J. D. Miller, Proc. Natl. Acad. Sci. U.S.A. 105, 437 (2008); 10.1073/pnas.0705792105 M. L. Cowan, B. D. Bruner, N. Huse, J. R. Dwyer, B. Chugh, E. T. J. Nibbering, T. Elsaesser, and R. J. D. Miller, Nature (London) 434, 199 (2005). 10.1038/nature03383
-
(2008)
Proc. Natl. Acad. Sci. U.S.A.
, vol.105
, pp. 437
-
-
Kraemer, D.1
Cowan, M.L.2
Paarman, A.3
Huse, N.4
Nibbering, E.T.J.5
Elsaesser, T.6
Miller, R.J.D.7
Cowan, M.L.8
Bruner, B.D.9
Huse, N.10
Dwyer, J.R.11
Chugh, B.12
Nibbering, E.T.J.13
Elsaesser, T.14
Miller, R.J.D.15
-
4
-
-
35748960831
-
-
10.1016/j.chemphys.2007.06.043
-
J. R. Schmidt, S. T. Roberts, J. J. Loparo, A. Tokmakoff, M. D. Fayer, and J. L. Skinner, Chem. Phys. 341, 143 (2007). 10.1016/j.chemphys.2007.06.043
-
(2007)
Chem. Phys.
, vol.341
, pp. 143
-
-
Schmidt, J.R.1
Roberts, S.T.2
Loparo, J.J.3
Tokmakoff, A.4
Fayer, M.D.5
Skinner, J.L.6
-
5
-
-
39749138302
-
Development of transferable interaction potentials for water. V. Extension of the flexible, polarizable, Thole-type model potential (TTM3-F, v. 3.0) to describe the vibrational spectra of water clusters and liquid water
-
DOI 10.1063/1.2837299
-
G. S. Fanourgakis and S. S. Xantheas, J. Chem. Phys. 128, 074506 (2008). 10.1063/1.2837299 (Pubitemid 351304958)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.7
, pp. 074506
-
-
Fanourgakis, G.S.1
Xantheas, S.S.2
-
7
-
-
44349195431
-
Probing intermolecular couplings in liquid water with two-dimensional infrared photon echo spectroscopy
-
DOI 10.1063/1.2919050
-
A. Paarmann, T. Hayashi, S. Mukamel, and R. J. D. Miller, J. Chem. Phys. 128, 191103 (2008). 10.1063/1.2919050 (Pubitemid 351733961)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.19
, pp. 191103
-
-
Paarmann, A.1
Hayashi, T.2
Mukamel, S.3
Miller, R.J.D.4
-
8
-
-
42949115392
-
Spectral signatures and molecular origin of acid dissociation intermediates
-
DOI 10.1021/ja077846o
-
R. Iftimie, V. Thomas, S. Plessis, P. Marchand, and P. Ayotte, J. Am. Chem. Soc. 130, 5901 (2008). 10.1021/ja077846o (Pubitemid 351620835)
-
(2008)
Journal of the American Chemical Society
, vol.130
, Issue.18
, pp. 5901-5907
-
-
Iftimie, R.1
Thomas, V.2
Plessis, S.3
Marchand, P.4
Ayotte, P.5
-
10
-
-
27644460495
-
Why is hydrofluoric acid a weak acid?
-
DOI 10.1063/1.2090259, 184501
-
P. Ayotte, M. Hbert, and P. Marchand, J. Chem. Phys. 123, 184501 (2005). 10.1063/1.2090259 (Pubitemid 41580111)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.18
, pp. 1-8
-
-
Ayotte, P.1
Hbert, M.2
Marchand, P.3
-
13
-
-
15944408390
-
Intermolecular vibration-vibration energy transfer in solution: Hydrogen fluoride in water
-
DOI 10.1016/j.cplett.2005.02.079
-
D. Laage, H. Demirdjian, and J. T. Hynes, Chem. Phys. Lett. 405, 453 (2005). 10.1016/j.cplett.2005.02.079 (Pubitemid 40431680)
-
(2005)
Chemical Physics Letters
, vol.405
, Issue.4-6
, pp. 453-458
-
-
Laage, D.1
Demirdjian, H.2
Hynes, J.T.3
-
14
-
-
0001087855
-
-
10.1103/PhysRevLett.82.600
-
E. D. Isaacs, A. Shukla, P. M. Platzman, D. R. Hamann, B. Barbiellini, and C. A. Tulk, Phys. Rev. Lett. 82, 600 (1999). 10.1103/PhysRevLett.82.600
-
(1999)
Phys. Rev. Lett.
, vol.82
, pp. 600
-
-
Isaacs, E.D.1
Shukla, A.2
Platzman, P.M.3
Hamann, D.R.4
Barbiellini, B.5
Tulk, C.A.6
-
15
-
-
0035396793
-
h
-
DOI 10.1063/1.1372183
-
A. H. Romero, P. L. Silvestrell, and M. Parrinello, J. Chem. Phys. 115, 115 (2001). 10.1063/1.1372183 (Pubitemid 32639800)
-
(2001)
Journal of Chemical Physics
, vol.115
, Issue.1
, pp. 115-123
-
-
Romero, A.H.1
Silvestrelli, P.L.2
Parrinello, M.3
-
18
-
-
0037206795
-
Structural and spectral properties of aqueous hydrogen fluoride studied using ab initio molecular dynamics
-
DOI 10.1021/jp0260088
-
A. J. Sillanpaeae, C. Simon, M. L. Klein, and K. Laasonen, J. Phys. Chem. B 106, 11315 (2002). 10.1021/jp0260088 (Pubitemid 35313772)
-
(2002)
Journal of Physical Chemistry B
, vol.106
, Issue.43
, pp. 11315-11322
-
-
Sillanpaa, A.J.1
Simon, C.2
Klein, M.L.3
Laasonen, K.4
-
20
-
-
79953208216
-
-
-1. Alternatively, this spectral feature also displays several qualitative attributes of a Fano resonance profile (coupling between a discrete bright state and a continuum of bright states) which describes the experimental spectroscopic profile equally well (not shown) and yields similarly large coupling constants
-
-1. Alternatively, this spectral feature also displays several qualitative attributes of a Fano resonance profile (coupling between a discrete bright state and a continuum of bright states) which describes the experimental spectroscopic profile equally well (not shown) and yields similarly large coupling constants.
-
-
-
-
21
-
-
2942534414
-
-
10.1063/1.1711596
-
S. Odde, B. J. Mhin, S. Lee, H. M. Lee, and K. S. Kim, J. Chem. Phys. 120, 9524 (2004). 10.1063/1.1711596
-
(2004)
J. Chem. Phys.
, vol.120
, pp. 9524
-
-
Odde, S.1
Mhin, B.J.2
Lee, S.3
Lee, H.M.4
Kim, K.S.5
-
22
-
-
11344274827
-
-
Gaussian, Inc., Wallingford, CT.
-
M. J. Frisch, GAUSSIAN 03, Revision E.01, Gaussian, Inc., Wallingford, CT, 2004.
-
(2004)
GAUSSIAN 03, Revision E.01
-
-
Frisch, M.J.1
-
23
-
-
79953174128
-
-
Furthermore, upon close examination of intermolecular vibrational couplings in neat liquid water and ice, another flaw of the prevalent electrostatic model was unravelled: (point) dipole-dipole couplings between vibrational modes of nearest neighbour water molecules are very small as the relative orientation between localized molecular transition dipoles (∼71 in tetrahedral H-bonded networks) approaches the magic angle
-
Furthermore, upon close examination of intermolecular vibrational couplings in neat liquid water and ice, another flaw of the prevalent electrostatic model was unravelled: (point) dipole-dipole couplings between vibrational modes of nearest neighbour water molecules are very small as the relative orientation between localized molecular transition dipoles (∼71 in tetrahedral H-bonded networks) approaches the magic angle.
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