SCOPUS 정보 검색 플랫폼

Volumn 125, Issue 24, 2006, Pages

Are recent water models obtained by fitting diffraction data consistent with infrared/Raman and x-ray absorption spectra?

(7) Leetmaa, Mikael a Ljungberg, Mathias a Ogasawara, Hirohito b Odelius, Michael a Näslund, Lars Åke a,b Nilsson, Anders a,b Pettersson, Lars G M a

a STOCKHOLM UNIVERSITY (Sweden)

b SLAC NATIONAL ACCELERATOR LABORATORY (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ASYMMETRICAL LOCAL COORDINATION; INTRAMOLECULAR DISTANCE; WATER MODELS;

ABSORPTION SPECTROSCOPY; HYDROGEN BONDS; NEUTRON DIFFRACTION; RAMAN SCATTERING; WATER; X RAY SPECTROSCOPY;

MOLECULAR STRUCTURE;

EID: 33846067146 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.2408419 Document Type: Article

Times cited : (62)

References (67)

1
- 27744460360
- A. K. Soper, J. Phys.: Condens. Matter 17, S3273 (2005).
- (2005) J. Phys.: Condens. Matter , vol.17 , pp. 3273
- Soper, A.K.¹

2
- 7444231098
- J. D. Smith, C. D. Cappa, K. R. Wilson, B. M. Messer, R. C. Cohen, and R. J. Saykally, Science 306, 851 (2004).
- (2004) Science , vol.306 , pp. 851
- Smith, J.D.¹ Cappa, C.D.² Wilson, K.R.³ Messer, B.M.⁴ Cohen, R.C.⁵ Saykally, R.J.⁶

3
- 20944436357
- A. Nilsson, Ph. Wernet, D. Nordlund, Science 308, 793a (2005).
- (2005) Science , vol.308
- Nilsson, A.¹ Wernet, Ph.² Nordlund, D.³

4
- 15944407594
- Y. A. Mantz, B. Chen, and G. J. Martyna, Chem. Phys. Lett. 405, 294 (2005).
- (2005) Chem. Phys. Lett. , vol.405 , pp. 294
- Mantz, Y.A.¹ Chen, B.² Martyna, G.J.³

5
- 26444538477
- J. D. Smith, C. D. Cappa, K. R. Wilson, R. C. Cohen, P. L. Geissler, and R. J. Saykally, Proc. Natl. Acad. Sci. U.S.A. 102, 14171 (2005).
- (2005) Proc. Natl. Acad. Sci. U.S.A. , vol.102 , pp. 14171
- Smith, J.D.¹ Cappa, C.D.² Wilson, K.R.³ Cohen, R.C.⁴ Geissler, P.L.⁵ Saykally, R.J.⁶

6
- 23244462990
- L. Å. Näslund, J. Lüning, Y. Ufuktepe, H. Ogasawara, Ph. Wernet, U. Bergmann, L. G. M. Pettersson, and A. Nilsson, J. Phys. Chem. B 109, 13835 (2005).
- (2005) J. Phys. Chem. B , vol.109 , pp. 13835
- Näslund, L.Å.¹ Lüning, J.² Ufuktepe, Y.³ Ogasawara, H.⁴ Wernet, Ph.⁵ Bergmann, U.⁶ Pettersson, L.G.M.⁷ Nilsson, A.⁸

7
- 23844547903
- M. Cavalleri, D. Nordlund, M. Odelius, A. Nilsson, and L. G. M. Pettersson, Phys. Chem. Chem. Phys. 7, 2854 (2005).
- (2005) Phys. Chem. Chem. Phys. , vol.7 , pp. 2854
- Cavalleri, M.¹ Nordlund, D.² Odelius, M.³ Nilsson, A.⁴ Pettersson, L.G.M.⁵

8
- 22844443925
- 0021-9606 10.1063/1.1940612
- D. Prendergast, J. C. Grossman, and G. Galli, J. Chem. Phys. 0021-9606 10.1063/1.1940612 123, 014501 (2005); Y. A. Mantz, B. Chen, and G. J. Martyna, J. Phys. Chem. B 110, 3540 (2006).
- (2005) J. Chem. Phys. , vol.123 , pp. 014501
- Prendergast, D.¹ Grossman, J.C.² Galli, G.³

9
- 33644968201
- D. Prendergast, J. C. Grossman, and G. Galli, J. Chem. Phys. 0021-9606 10.1063/1.1940612 123, 014501 (2005); Y. A. Mantz, B. Chen, and G. J. Martyna, J. Phys. Chem. B 110, 3540 (2006).
- (2006) J. Phys. Chem. B , vol.110 , pp. 3540
- Mantz, Y.A.¹ Chen, B.² Martyna, G.J.³

10
- 33744730795
- D. Prendergast and G. Galli, Phys. Rev. Lett. 96, 215502 (2006).
- (2006) Phys. Rev. Lett. , vol.96 , pp. 215502
- Prendergast, D.¹ Galli, G.²

11
- 33744501242
- T. Head-Gordon and M. E. Johnson, Proc. Natl. Acad. Sci. U.S.A. 103, 7973 (2006).
- (2006) Proc. Natl. Acad. Sci. U.S.A. , vol.103 , pp. 7973
- Head-Gordon, T.¹ Johnson, M.E.²

12
- 32644459555
- M. V. Fernandez-Serra and E. Artacho, Phys. Rev. Lett. 96, 016404 (2006).
- (2006) Phys. Rev. Lett. , vol.96 , pp. 016404
- Fernandez-Serra, M.V.¹ Artacho, E.²

13
- 33244477644
- M. Odelius, M. Cavalleri, A. Nilsson, and L. G. M. Pettersson, Phys. Rev. B 73, 024205 (2006).
- (2006) Phys. Rev. B , vol.73 , pp. 024205
- Odelius, M.¹ Cavalleri, M.² Nilsson, A.³ Pettersson, L.G.M.⁴

14
- 2342558053
- Ph. Wernet, D. Nordlund, U. Bergmann, Science 304 (5673), 995 (2004).
- (2004) Science , vol.304 , Issue.5673 , pp. 995
- Wernet, Ph.¹ Nordlund, D.² Bergmann, U.³

15
- 0346735076
- J. D. Bernal and R. H. Fowler, J. Chem. Phys. 1, 515 (1933).
- (1933) J. Chem. Phys. , vol.1 , pp. 515
- Bernal, J.D.¹ Fowler, R.H.²

16
- 37049247339
- A. H. Narten and H. A. Levy, Science 165, 447 (1969).
- (1969) Science , vol.165 , pp. 447
- Narten, A.H.¹ Levy, H.A.²

17
- 33845790250
- A. Rahman and F. H. Stillinger, J. Chem. Phys. 55, 3336 (1971).
- (1971) J. Chem. Phys. , vol.55 , pp. 3336
- Rahman, A.¹ Stillinger, F.H.²

18
- 0036836445
- B. Guillot, J. Mol. Liq. 101, 219 (2003).
- (2003) J. Mol. Liq. , vol.101 , pp. 219
- Guillot, B.¹

19
- 0034317110
- G. Hura, J. M. Sorenson, R. M. Glaeser, and T. Head-Gordon, J. Chem. Phys. 113, 9140 (2000).
- (2000) J. Chem. Phys. , vol.113 , pp. 9140
- Hura, G.¹ Sorenson, J.M.² Glaeser, R.M.³ Head-Gordon, T.⁴

20
- 0034316640
- J. M. Sorenson, G. Hura, R. M. Glaeser, and T. Head-Gordon, J. Chem. Phys. 113, 9149 (2000).
- (2000) J. Chem. Phys. , vol.113 , pp. 9149
- Sorenson, J.M.¹ Hura, G.² Glaeser, R.M.³ Head-Gordon, T.⁴

21
- 33750812429
- T. Head-Gordon and M. E. Johnson, Proc. Natl. Acad. Sci. U.S.A. 103, 16614 (2006).
- (2006) Proc. Natl. Acad. Sci. U.S.A. , vol.103 , pp. 16614
- Head-Gordon, T.¹ Johnson, M.E.²

22
- 33846088684
- L. Fu, S. Brennan, and A. Bienenstock (unpublished).
- Fu, L.¹ Brennan, S.² Bienenstock, A.³

23
- 33644930847
- 1089-5647 10.1021/jp055127v
- T. Todorova, A. P. Seitsonen, J. Hutter, I.-F. W. Kuo, and C. J. Mundy, J. Phys. Chem. B 1089-5647 10.1021/jp055127v 110, 3685 (2006); J. Vandevondele, F. Mohamed, M. Krack, J. Hutter, M. Sprik, and M. Parrinello, J. Chem. Phys. 0021-9606 10.1063/1.1828433 122, 014515 (2005); J. C. Grossman, E. Schwegler, E. W. Draeger, F. Gygi, and G. Galli, J. Chem. Phys. 0021-9606 10.1063/1.1630560 120, 300 (2004); E. Schwegler, J. C. Grossman, F. Gygi, and G. Galli, J. Chem. Phys. 121, 5400 (2004).
- (2006) J. Phys. Chem. B , vol.110 , pp. 3685
- Todorova, T.¹ Seitsonen, A.P.² Hutter, J.³ Kuo, I.-F.W.⁴ Mundy, C.J.⁵

24
- 22944439420
- 0021-9606 10.1063/1.1828433
- T. Todorova, A. P. Seitsonen, J. Hutter, I.-F. W. Kuo, and C. J. Mundy, J. Phys. Chem. B 1089-5647 10.1021/jp055127v 110, 3685 (2006); J. Vandevondele, F. Mohamed, M. Krack, J. Hutter, M. Sprik, and M. Parrinello, J. Chem. Phys. 0021-9606 10.1063/1.1828433 122, 014515 (2005); J. C. Grossman, E. Schwegler, E. W. Draeger, F. Gygi, and G. Galli, J. Chem. Phys. 0021-9606 10.1063/1.1630560 120, 300 (2004); E. Schwegler, J. C. Grossman, F. Gygi, and G. Galli, J. Chem. Phys. 121, 5400 (2004).
- (2005) J. Chem. Phys. , vol.122 , pp. 014515
- Vandevondele, J.¹ Mohamed, F.² Krack, M.³ Hutter, J.⁴ Sprik, M.⁵ Parrinello, M.⁶

25
- 0942288567
- 0021-9606 10.1063/1.1630560
- T. Todorova, A. P. Seitsonen, J. Hutter, I.-F. W. Kuo, and C. J. Mundy, J. Phys. Chem. B 1089-5647 10.1021/jp055127v 110, 3685 (2006); J. Vandevondele, F. Mohamed, M. Krack, J. Hutter, M. Sprik, and M. Parrinello, J. Chem. Phys. 0021-9606 10.1063/1.1828433 122, 014515 (2005); J. C. Grossman, E. Schwegler, E. W. Draeger, F. Gygi, and G. Galli, J. Chem. Phys. 0021-9606 10.1063/1.1630560 120, 300 (2004); E. Schwegler, J. C. Grossman, F. Gygi, and G. Galli, J. Chem. Phys. 121, 5400 (2004).
- (2004) J. Chem. Phys. , vol.120 , pp. 300
- Grossman, J.C.¹ Schwegler, E.² Draeger, E.W.³ Gygi, F.⁴ Galli, G.⁵

26
- 4944230287
- T. Todorova, A. P. Seitsonen, J. Hutter, I.-F. W. Kuo, and C. J. Mundy, J. Phys. Chem. B 1089-5647 10.1021/jp055127v 110, 3685 (2006); J. Vandevondele, F. Mohamed, M. Krack, J. Hutter, M. Sprik, and M. Parrinello, J. Chem. Phys. 0021-9606 10.1063/1.1828433 122, 014515 (2005); J. C. Grossman, E. Schwegler, E. W. Draeger, F. Gygi, and G. Galli, J. Chem. Phys. 0021-9606 10.1063/1.1630560 120, 300 (2004); E. Schwegler, J. C. Grossman, F. Gygi, and G. Galli, J. Chem. Phys. 121, 5400 (2004).
- (2004) J. Chem. Phys. , vol.121 , pp. 5400
- Schwegler, E.¹ Grossman, J.C.² Gygi, F.³ Galli, G.⁴

27
- 0346421113
- B. Chen, I. Ivanov, M. L. Klein, and M. Parrinello, Phys. Rev. Lett. 91, 215503 (2003).
- (2003) Phys. Rev. Lett. , vol.91 , pp. 215503
- Chen, B.¹ Ivanov, I.² Klein, M.L.³ Parrinello, M.⁴

28
- 33846051200
- K. Hermann, L. G. M. Pettersson, M. E. Casida, STOBE software, 2005.
- (2005)
- Hermann, K.¹ Pettersson, L.G.M.² Casida, M.E.³

29
- 84908253077
- L. Triguero, L. G. M. Pettersson, and H. Ågren, Phys. Rev. B 58, 8097 (1998).
- (1998) Phys. Rev. B , vol.58 , pp. 8097
- Triguero, L.¹ Pettersson, L.G.M.² Ågren, H.³

30
- 0031253613
- H. Ågren, V. Carravetta, O. Vahtras, and L. G. M. Pettersson, Theor. Chem. Acc. 97, 14 (1997).
- (1997) Theor. Chem. Acc. , vol.97 , pp. 14
- Ågren, H.¹ Carravetta, V.² Vahtras, O.³ Pettersson, L.G.M.⁴

31
- 0035828676
- C. Kolczewski, R. Püttner, O. Plashkevych, J. Chem. Phys. 115, 6426 (2001).
- (2001) J. Chem. Phys. , vol.115 , pp. 6426
- Kolczewski, C.¹ Püttner, R.² Plashkevych, O.³

32
- 36849140788
- S. Huzinaga, J. Chem. Phys. 42, 1293 (1965).
- (1965) J. Chem. Phys. , vol.42 , pp. 1293
- Huzinaga, S.¹

33
- 0004165142
- Springer, Heidelberg
- W. Kutzelnigg, U. Fleischer, and M. Schindler, NMR-Basic Principles and Progress (Springer, Heidelberg, 1990).
- (1990) NMR-Basic Principles and Progress
- Kutzelnigg, W.¹ Fleischer, U.² Schindler, M.³

34
- 36549099640
- L. G. M. Pettersson, U. Wahlgren, and O. Gropen, J. Chem. Phys. 86, 2176 (1987).
- (1987) J. Chem. Phys. , vol.86 , pp. 2176
- Pettersson, L.G.M.¹ Wahlgren, U.² Gropen, O.³

35
- 4243553426
- A. D. Becke, Phys. Rev. A 38, 3098 (1988).
- (1988) Phys. Rev. A , vol.38 , pp. 3098
- Becke, A.D.¹

36
- 5944261746
- J. P. Perdew, Phys. Rev. B 33, 8822 (1986).
- (1986) Phys. Rev. B , vol.33 , pp. 8822
- Perdew, J.P.¹

37
- 10844237163
- O. Takahashi and L. G. M. Pettersson, J. Chem. Phys. 121, 10339 (2004).
- (2004) J. Chem. Phys. , vol.121 , pp. 10339
- Takahashi, O.¹ Pettersson, L.G.M.²

38
- 0142155167
- R. Sankari, M. Ehara, H. Nakatsuji, Y. Senba, K. Hosokawa, H. Tyoshida, A. De Fanis, Y. Tamenori, S. Aksela, and K. Ueda, Chem. Phys. Lett. 380, 647 (2003).
- (2003) Chem. Phys. Lett. , vol.380 , pp. 647
- Sankari, R.¹ Ehara, M.² Nakatsuji, H.³ Senba, Y.⁴ Hosokawa, K.⁵ Tyoshida, H.⁶ De Fanis, A.⁷ Tamenori, Y.⁸ Aksela, S.⁹ Ueda, K.¹⁰

39
- 4444340929
- W. S. Benedict, N. Gailar, and E. K. Phylar, J. Chem. Phys. 24, 1139 (1956).
- (1956) J. Chem. Phys. , vol.24 , pp. 1139
- Benedict, W.S.¹ Gailar, N.² Phylar, E.K.³

40
- 2442440650
- S. A. Corcelli, C. P. Lawrence, and J. L. Skinner, J. Chem. Phys. 120, 8107 (2004).
- (2004) J. Chem. Phys. , vol.120 , pp. 8107
- Corcelli, S.A.¹ Lawrence, C.P.² Skinner, J.L.³

41
- 23144465421
- S. A. Corcelli and J. L. Skinner, J. Phys. Chem. A 109, 6154 (2005).
- (2005) J. Phys. Chem. A , vol.109 , pp. 6154
- Corcelli, S.A.¹ Skinner, J.L.²

42
- 12344281408
- T. Hayashi, T. Jansen, W. Zhuang, and S. Mukamel, J. Phys. Chem. A 109, 64 (2005).
- (2005) J. Phys. Chem. A , vol.109 , pp. 64
- Hayashi, T.¹ Jansen, T.² Zhuang, W.³ Mukamel, S.⁴

43
- 33846118126
- Gaussian Inc., Pittsburgh, PA
- M. J. Frisch, G. W. Trucks, H. B. Schlegel, GAUSSIAN 98 Gaussian Inc., Pittsburgh, PA, 1998.
- (1998)
- Frisch, M.J.¹ Trucks, G.W.² Schlegel, H.B.³

44
- 33846102773
- V. Barone, J. Chem. Phys. 122, 104108 (2005).
- (2005) J. Chem. Phys. , vol.122 , pp. 104108
- Barone, V.¹

45
- 0037017586
- S. Myneni, Y. Luo, L. Å. Näslund, J. Phys.: Condens. Matter 14, L213 (2002).
- (2002) J. Phys.: Condens. Matter , vol.14 , pp. 213
- Myneni, S.¹ Luo, Y.² Näslund, L.Å.³

46
- 0037020221
- M. Cavalleri, H. Ogasawara, L. G. M. Pettersson, and A. Nilsson, Chem. Phys. Lett. 364, 363 (2002).
- (2002) Chem. Phys. Lett. , vol.364 , pp. 363
- Cavalleri, M.¹ Ogasawara, H.² Pettersson, L.G.M.³ Nilsson, A.⁴

47
- 0023308066
- W. F. Kuhs and M. S. Lehmann, J. Phys. Colloq. C1, 3 (1987).
- (1987) J. Phys. Colloq. , vol.1 , pp. 3
- Kuhs, W.F.¹ Lehmann, M.S.²

48
- 33749367366
- K. Nygrd, M. Hakala, S. Manninen, A. Andrejczuk, M. Itou, Y. Sakurai, L. G. M. Pettersson, and K. Hämäläinen, Phys. Rev. E 74, 031503 (2006).
- (2006) Phys. Rev. e , vol.74 , pp. 031503
- Nygrd, K.¹ Hakala, M.² Manninen, S.³ Andrejczuk, A.⁴ Itou, M.⁵ Sakurai, Y.⁶ Pettersson, L.G.M.⁷ Hämäläinen, K.⁸

49
- 0035935401
- H. A. Stern and B. J. Berne, J. Chem. Phys. 115, 7622 (2001).
- (2001) J. Chem. Phys. , vol.115 , pp. 7622
- Stern, H.A.¹ Berne, B.J.²

50
- 0000228904
- 0031-9007 10.1103/PhysRevLett.76.956
- K. S. Kim, I. Park, S. Lee, K. Cho, J. Y. Lee, J. Kim, and J. D. Joannopoulos, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.76.956 76, 956 (1996); L. Kevan, Acc. Chem. Res. 14, 138 (1981).
- (1996) Phys. Rev. Lett. , vol.76 , pp. 956
- Kim, K.S.¹ Park, I.² Lee, S.³ Cho, K.⁴ Lee, J.Y.⁵ Kim, J.⁶ Joannopoulos, J.D.⁷

51
- 33845555949
- K. S. Kim, I. Park, S. Lee, K. Cho, J. Y. Lee, J. Kim, and J. D. Joannopoulos, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.76.956 76, 956 (1996); L. Kevan, Acc. Chem. Res. 14, 138 (1981).
- (1981) Acc. Chem. Res. , vol.14 , pp. 138
- Kevan, L.¹

52
- 33846040997
- NSRDS-NBS 39
- T. Shimanouchi, Report No. NSRDS-NBS 39, 1972.
- (1972)
- Shimanouchi, T.¹

53
- 18844410777
- K. Diri, E. M. Myshakin, and K. D. Jordan, J. Phys. Chem. A 109, 4005 (2005).
- (2005) J. Phys. Chem. A , vol.109 , pp. 4005
- Diri, K.¹ Myshakin, E.M.² Jordan, K.D.³

54
- 0004237782
- Springer-Verlag, Berlin
- J. Stöhr, NEXAFS Spectroscopy (Springer-Verlag, Berlin, 1992).
- (1992) NEXAFS Spectroscopy
- Stöhr, J.¹

55
- 0043282031
- 0009-2614 10.1016/S0009-2614(99)00859-3
- L. G. M. Pettersson, T. Hatsui, and N. Kosugi, Chem. Phys. Lett. 0009-2614 10.1016/S0009-2614(99)00859-3 311, 299 (1999); R. G. Wilks, J. B. Macnaughton, H. B. Kraatz, T. Regier, and A. Moewes, J. Phys. Chem. B 110, 5955 (2006).
- (1999) Chem. Phys. Lett. , vol.311 , pp. 299
- Pettersson, L.G.M.¹ Hatsui, T.² Kosugi, N.³

56
- 33645807139
- L. G. M. Pettersson, T. Hatsui, and N. Kosugi, Chem. Phys. Lett. 0009-2614 10.1016/S0009-2614(99)00859-3 311, 299 (1999); R. G. Wilks, J. B. Macnaughton, H. B. Kraatz, T. Regier, and A. Moewes, J. Phys. Chem. B 110, 5955 (2006).
- (2006) J. Phys. Chem. B , vol.110 , pp. 5955
- Wilks, R.G.¹ MacNaughton, J.B.² Kraatz, H.B.³ Regier, T.⁴ Moewes, A.⁵

57
- 0037460523
- 0021-9606 10.1063/1.1539866
- H. Öström, L. Triguero, K. Weiss, H. Ogasawara, M. G. Garnier, D. Nordlund, M. Nyberg, L. G. M. Pettersson, and A. Nilsson, J. Chem. Phys. 0021-9606 10.1063/1.1539866 118, 3782 (2004); K. Weiss, H. Öström, L. Triguero, H. Ogasawara, M. G. Garnier, L. G. M. Pettersson, and A. Nilsson, J. Electron Spectrosc. Relat. Phenom. 128, 179 (2003).
- (2004) J. Chem. Phys. , vol.118 , pp. 3782
- Öström, H.¹ Triguero, L.² Weiss, K.³ Ogasawara, H.⁴ Garnier, M.G.⁵ Nordlund, D.⁶ Nyberg, M.⁷ Pettersson, L.G.M.⁸ Nilsson, A.⁹

58
- 0037320499
- H. Öström, L. Triguero, K. Weiss, H. Ogasawara, M. G. Garnier, D. Nordlund, M. Nyberg, L. G. M. Pettersson, and A. Nilsson, J. Chem. Phys. 0021-9606 10.1063/1.1539866 118, 3782 (2004); K. Weiss, H. Öström, L. Triguero, H. Ogasawara, M. G. Garnier, L. G. M. Pettersson, and A. Nilsson, J. Electron Spectrosc. Relat. Phenom. 128, 179 (2003).
- (2003) J. Electron Spectrosc. Relat. Phenom. , vol.128 , pp. 179
- Weiss, K.¹ Öström, H.² Triguero, L.³ Ogasawara, H.⁴ Garnier, M.G.⁵ Pettersson, L.G.M.⁶ Nilsson, A.⁷

59
- 0037203453
- H. Ogasawara, B. Brena, D. Nordlund, M. Nyberg, A. Pelmenschikov, L. G. M. Pettersson, and A. Nilsson, Phys. Rev. Lett. 89, 276102 (2002).
- (2002) Phys. Rev. Lett. , vol.89 , pp. 276102
- Ogasawara, H.¹ Brena, B.² Nordlund, D.³ Nyberg, M.⁴ Pelmenschikov, A.⁵ Pettersson, L.G.M.⁶ Nilsson, A.⁷

60
- 20344394436
- K. R. Wilson, B. S. Rude, R. D. Schaller, T. Catalano, R. J. Saykally, M. Cavalleri, A. Nilsson, and L. G. M. Pettersson, J. Phys. Chem. B 109, 10194 (2005).
- (2005) J. Phys. Chem. B , vol.109 , pp. 10194
- Wilson, K.R.¹ Rude, B.S.² Schaller, R.D.³ Catalano, T.⁴ Saykally, R.J.⁵ Cavalleri, M.⁶ Nilsson, A.⁷ Pettersson, L.G.M.⁸

61
- 0346688925
- M. Nyberg, M. Odelius, A. Nilsson, and L. G. M. Pettersson, J. Chem. Phys. 119, 12577 (2003).
- (2003) J. Chem. Phys. , vol.119 , pp. 12577
- Nyberg, M.¹ Odelius, M.² Nilsson, A.³ Pettersson, L.G.M.⁴

62
- 4243606192
- R. Car and M. Parrinello, Phys. Rev. Lett. 55, 2471 (1985).
- (1985) Phys. Rev. Lett. , vol.55 , pp. 2471
- Car, R.¹ Parrinello, M.²

63
- 10844262441
- M. Cavalleri, M. Odelius, A. Nilsson, and L. G. M. Pettersson, J. Chem. Phys. 121, 10065 (2004).
- (2004) J. Chem. Phys. , vol.121 , pp. 10065
- Cavalleri, M.¹ Odelius, M.² Nilsson, A.³ Pettersson, L.G.M.⁴

64
- 2542496884
- B. Hetenyi, F. De Angelis, P. Gianozzi, and R. Car, J. Chem. Phys. 120, 8632 (2004).
- (2004) J. Chem. Phys. , vol.120 , pp. 8632
- Hetenyi, B.¹ De Angelis, F.² Gianozzi, P.³ Car, R.⁴

65
- 0038492095
- 1089-5639 10.1021/jp994492h
- J. C. Deak, S. T. Rhea, L. K. Iwaki, and D. D. Dlott, J. Phys. Chem. A 1089-5639 10.1021/jp994492h 104, 4866 (2000); Z. Wang, A. Pakoulev, Y. Pang, and D. D. Dlott, J. Phys. Chem. A 108, 9054 (2004).
- (2000) J. Phys. Chem. A , vol.104 , pp. 4866
- Deak, J.C.¹ Rhea, S.T.² Iwaki, L.K.³ Dlott, D.D.⁴

66
- 7544228565
- J. C. Deak, S. T. Rhea, L. K. Iwaki, and D. D. Dlott, J. Phys. Chem. A 1089-5639 10.1021/jp994492h 104, 4866 (2000); Z. Wang, A. Pakoulev, Y. Pang, and D. D. Dlott, J. Phys. Chem. A 108, 9054 (2004).
- (2004) J. Phys. Chem. A , vol.108 , pp. 9054
- Wang, Z.¹ Pakoulev, A.² Pang, Y.³ Dlott, D.D.⁴

67
- 0141432008
- C. J. Fecko, J.. D. Eaves, J. J. Loparo, A. Tokmakoff, and P. L. Geissler, Science 301, 1698 (2003).
- (2003) Science , vol.301 , pp. 1698
- Fecko, C.J.¹ Eaves, J.D.² Loparo, J.J.³ Tokmakoff, A.⁴ Geissler, P.L.⁵

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