SCOPUS 정보 검색 플랫폼

Journal of Physical Chemistry A

Volumn 102, Issue 51, 1998, Pages

Mixed quantum/classical dynamics of hydrogen transfer reactions

(1) Hammes Schiffer, Sharon a

a UNIVERSITY OF NOTRE DAME (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 11744276220 PISSN: 10895639 EISSN: None Source Type: Journal
DOI: 10.1021/jp983246n Document Type: Review

Times cited : (23)

References (126)

1
- 33847799412
- Blow, D. M. Acc. Chem. Res. 1976, 9, 145.
- (1976) Acc. Chem. Res. , vol.9 , pp. 145
- Blow, D.M.¹

2
- 0343503625
- Zundel, G. J. Mol. Struct. 1988, 177, 43.
- (1988) Mol. Struct. , vol.177 , pp. 43
- Zundel, G.J.¹

3
- 0023792892
- Sekhar, V. C.; Plapp, B. V. Biochemistry 1988, 27, 5082.
- (1988) Biochemistry , vol.27 , pp. 5082
- Sekhar, V.C.¹ Plapp, B.V.²

4
- 0029077909
- Ren, X.; Tu, C.; Laipis, P. J.; Silverman, D. N. Biochemistry 1995, 34, 8492.
- (1995) Biochemistry , vol.34 , pp. 8492
- Ren, X.¹ Tu, C.² Laipis, P.J.³ Silverman, D.N.⁴

5
- 0025230262
- Therien, M. J.; Selman, M.; Gray, H. B.; Chang, I.-J.; Winkler, J. R. J. Am. Chem. Soc. 1990, 112, 2420.
- (1990) J. Am. Chem. Soc. , vol.112 , pp. 2420
- Therien, M.J.¹ Selman, M.² Gray, H.B.³ Chang, I.-J.⁴ Winkler, J.R.⁵

6
- 0000911922
- Onuchic, J. N.; Beraten, D. N. J. Chem. Phys. 1990, 92, 722.
- (1990) J. Chem. Phys. , vol.92 , pp. 722
- Onuchic, J.N.¹ Beraten, D.N.²

7
- 0024836485
- Babcock, G. T.; Barry, B. A.; Debus, R. J.; Hoganson, C. W.; Atamian, M.; McIntosh, L.; Sithole, I.; Yocum, C. F. Biochemistry 1989, 28, 9557.
- (1989) Biochemistry , vol.28 , pp. 9557
- Babcock, G.T.¹ Barry, B.A.² Debus, R.J.³ Hoganson, C.W.⁴ Atamian, M.⁵ McIntosh, L.⁶ Sithole, I.⁷ Yocum, C.F.⁸

8
- 0026718120
- Okamura, M. Y.; Feher, G. Annu. Rev. Biochem. 1992, 61, 861.
- (1992) Annu. Rev. Biochem. , vol.61 , pp. 861
- Okamura, M.Y.¹ Feher, G.²

9
- 0003419532
- Plenum: New York
- Kirmaier, C.; Holten, D. The Photosynthetic Bacterial Reaction Center - Structure and Dynamics; Plenum: New York, 1988.
- (1988) The Photosynthetic Bacterial Reaction Center - Structure and Dynamics
- Kirmaier, C.¹ Holten, D.²

10
- 0024571740
- Wikstrom, M. Nature 1989, 338, 776.
- (1989) Nature , vol.338 , pp. 776
- Wikstrom, M.¹

11
- 0026530174
- Babcock, G. T.; Wikstrom, M. Nature 1992, 356, 301.
- (1992) Nature , vol.356 , pp. 301
- Babcock, G.T.¹ Wikstrom, M.²

12
- 2442609830
- Malmstrom, B. G. Acc. Chem. Res. 1993, 26, 332.
- (1993) Acc. Chem. Res. , vol.26 , pp. 332
- Malmstrom, B.G.¹

13
- 84986512474
- Brooks, B. R.; Bruccoleri, R. E.; Olafson, B. D.; States, D. J.; Swaminathan, S.; Karplus, M. J. Compta. Chem. 1983, 4, 187.
- (1983) J. Compta. Chem. , vol.4 , pp. 187
- Brooks, B.R.¹ Bruccoleri, R.E.² Olafson, B.D.³ States, D.J.⁴ Swaminathan, S.⁵ Karplus, M.⁶

14
- 0029011701
- Cornell, W. D.; Cieplak, P.; Bayly, C. I.; Gould, I. R.; K. M. Merz, Jr.; Ferguson, D. M.; Spellmeyer, D. C.; Fox, T.; Caldwell, J. W.; Kollman, P. A. J. Am. Chem. Soc. 1995, 117, 5179.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 5179
- Cornell, W.D.¹ Cieplak, P.² Bayly, C.I.³ Gould, I.R.⁴ Merz Jr., K.M.⁵ Ferguson, D.M.⁶ Spellmeyer, D.C.⁷ Fox, T.⁸ Caldwell, J.W.⁹ Kollman, P.A.¹⁰

15
- 33845379042
- Chandrasekhar, J.; Smith, S. F.; Jorgensen, W. L. J. Am. Chem. Soc. 1985, 107, 154.
- (1985) J. Am. Chem. Soc. , vol.107 , pp. 154
- Chandrasekhar, J.¹ Smith, S.F.² Jorgensen, W.L.³

16
- 0013584904
- Search for Analytical Functions to Simulate Proton Transfers in Hydrogen Bonds
- Smith, D., Ed.; American Chemical Society: Washington, DC
- Scheiner, S.; Duan, X. Search for Analytical Functions to Simulate Proton Transfers in Hydrogen Bonds. In Modeling the Hydrogen Bond, Smith, D., Ed.; American Chemical Society: Washington, DC, 1994; Vol. 569, p 125.
- (1994) Modeling the Hydrogen Bond , vol.569 , pp. 125
- Scheiner, S.¹ Duan, X.²

17
- 4243606192
- Car, R.; Parrinello, M. Phys. Rev. Lett. 1985, 55, 2471.
- (1985) Phys. Rev. Lett. , vol.55 , pp. 2471
- Car, R.¹ Parrinello, M.²

18
- 0017100947
- Watshel, A.; Levitt, M. J. Mol. Biol. 1976, 103, 227.
- (1976) J. Mol. Biol. , vol.103 , pp. 227
- Watshel, A.¹ Levitt, M.²

19
- 84988053595
- Singh, U.; Kollman, P. J. Comput. Chem. 1986, 7, 718.
- (1986) Comput. Chem. , vol.7 , pp. 718
- Singh, U.¹ Kollman, P.J.²

20
- 84986513644
- Field, M. J.; Bash, P. A.; Karplus, M. J. Comput. Chem. 1990, 11, 700.
- (1990) Comput. Chem. , vol.11 , pp. 700
- Field, M.J.¹ Bash, P.A.² Karplus, M.J.³

21
- 4243810035
- Aqvist, J.; Warshel, A. Chem. Rev. 1993, 93, 2523.
- (1993) Chem. Rev. , vol.93 , pp. 2523
- Aqvist, J.¹ Warshel, A.²

22
- 0001491955
- Gao, J. Acc. Chem. Res. 1996, 29, 298.
- (1996) Acc. Chem. Res. , vol.29 , pp. 298
- Gao, J.¹

23
- 36449005418
- Hammes-Schiffer, S.; Tully, J. C. J. Chem. Phys. 1994, 101, 4657.
- (1994) J. Chem. Phys. , vol.101 , pp. 4657
- Hammes-Schiffer, S.¹ Tully, J.C.²

24
- 0000084371
- Morillo, M.; Cukier, R. I. J. Chem. Phys. 1990, 92, 4833.
- (1990) J. Chem. Phys. , vol.92 , pp. 4833
- Morillo, M.¹ Cukier, R.I.²

25
- 0041642741
- Warshel, A.; Chu, Z. T. J. Chem. Phys. 1990, 93, 4003.
- (1990) J. Chem. Phys. , vol.93 , pp. 4003
- Warshel, A.¹ Chu, Z.T.²

26
- 0028493928
- Truhlar, D. G.; Liu, Y.-P.; Schenter, G. K.; Garrett, B. C. J. Phys. Chem. 1994, 98, 8396.
- (1994) J. Phys. Chem. , vol.98 , pp. 8396
- Truhlar, D.G.¹ Liu, Y.-P.² Schenter, G.K.³ Garrett, B.C.⁴

27
- 0001323710
- Borgis, D.; Tarjus, G.; Azzouz, H. J. Phys. Chem. 1992, 96, 3188.
- (1992) J. Phys. Chem. , vol.96 , pp. 3188
- Borgis, D.¹ Tarjus, G.² Azzouz, H.³

28
- 36449006287
- Borgis, D.; Tarjus, G.; Azzouz, H. J. Chem. Phys. 1992, 97, 1390.
- (1992) J. Chem. Phys. , vol.97 , pp. 1390
- Borgis, D.¹ Tarjus, G.² Azzouz, H.³

29
- 0000026701
- Laria, D.; Ciccotti, G.; Ferrario, M.; Kapral, R. J. Chem. Phys. 1992, 97, 378.
- (1992) J. Chem. Phys. , vol.97 , pp. 378
- Laria, D.¹ Ciccotti, G.² Ferrario, M.³ Kapral, R.⁴

30
- 0346725553
- Borgis, D.; Hynes, J. T. Chem. Phys. 1993, 170, 315.
- (1993) Chem. Phys. , vol.170 , pp. 315
- Borgis, D.¹ Hynes, J.T.²

31
- 33751385143
- Mavri, J.; Berendsen, H. J. C.; van Gunsteren, W. F. J. Phys. Chem. 1993, 97, 13469.
- (1993) J. Phys. Chem. , vol.97 , pp. 13469
- Mavri, J.¹ Berendsen, H.J.C.² Van Gunsteren, W.F.³

32
- 0000473772
- Mavri, J.; Berendsen, H. J. C. J. Phys. Chem. 1995, 99, 12711.
- (1995) J. Phys. Chem. , vol.99 , pp. 12711
- Mavri, J.¹ Berendsen, H.J.C.²

33
- 27844452636
- Staib, A.; Borgis, D.; Hynes, J. T. J. Chem. Phys. 1995, 102, 2487.
- (1995) J. Chem. Phys. , vol.102 , pp. 2487
- Staib, A.¹ Borgis, D.² Hynes, J.T.³

34
- 0001869980
- Ando, K.; Hynes, J. T. J. Mol. Liq. 1995, 64, 25.
- (1995) J. Mol. Liq. , vol.64 , pp. 25
- Ando, K.¹ Hynes, J.T.²

35
- 25944434685
- Bala, P.; Lesyng, B.; McCammon, J. A Chem. Phys. 1994, 180, 271.
- (1994) Chem. Phys. , vol.180 , pp. 271
- Bala, P.¹ Lesyng, B.² McCammon, J.A.³

36
- 4243168870
- Hammes-Schiffer, S.; Tully, J. C. J. Phys. Chem. 1995, 99, 5793.
- (1995) J. Phys. Chem. , vol.99 , pp. 5793
- Hammes-Schiffer, S.¹ Tully, J.C.²

37
- 33751500683
- Li, D.; Voth, G. A. J. Phys. Chem. 1991, 95, 10425.
- (1991) J. Phys. Chem. , vol.95 , pp. 10425
- Li, D.¹ Voth, G.A.²

38
- 33751386561
- Hwang, J.-K.; Warshel, A. J. Phys. Chem. 1993, 97, 10053.
- (1993) J. Phys. Chem. , vol.97 , pp. 10053
- Hwang, J.-K.¹ Warshel, A.²

39
- 0040193886
- Hwang, J.-K.; Chu, Z. T.; Yadav, A.; Warshel, A. J. Phys. Chem. 1991, 95, 8445.
- (1991) J. Phys. Chem. , vol.95 , pp. 8445
- Hwang, J.-K.¹ Chu, Z.T.² Yadav, A.³ Warshel, A.⁴

40
- 0001680162
- Lobaugh, J.; Voth, G. A. Chem. Phys. Lett. 1992, 198, 311.
- (1992) Chem. Phys. Lett. , vol.198 , pp. 311
- Lobaugh, J.¹ Voth, G.A.²

41
- 36449003037
- Lobaugh, J.; Voth, G. A. J. Chem. Phys. 1994, 100, 3039.
- (1994) J. Chem. Phys. , vol.100 , pp. 3039
- Lobaugh, J.¹ Voth, G.A.²

42
- 0000044605
- Azzouz, H.; Borgis, D. J. Chem. Phys. 1993, 98, 7361.
- (1993) J. Chem. Phys. , vol.98 , pp. 7361
- Azzouz, H.¹ Borgis, D.²

43
- 0000214894
- Pomès, R.; Roux, B. Chem. Phys. Lett. 1995, 234, 416.
- (1995) Chem. Phys. Lett. , vol.234 , pp. 416
- Pomès, R.¹ Roux, B.²

44
- 33748662705
- Pomès, R.; Roux, B. J. Phys. Chem. 1996, 100, 2519.
- (1996) J. Phys. Chem. , vol.100 , pp. 2519
- Pomès, R.¹ Roux, B.²

45
- 5944238344
- Lobaugh, J.; Voth, G. A. J. Chem. Phys. 1996, 104, 2056.
- (1996) J. Chem. Phys. , vol.104 , pp. 2056
- Lobaugh, J.¹ Voth, G.A.²

46
- 0031337237
- Billeter, S. R.; van Gunsteren, W. F. Comput. Phys. Commun. 1997, 107, 61.
- (1997) Comput. Phys. Commun. , vol.107 , pp. 61
- Billeter, S.R.¹ Van Gunsteren, W.F.²

47
- 33748659289
- Bala, P.; Grochowski, P.; Lesyng, B.; McCammon, J. A. J. Phys. Chem. 1996, 100, 2535.
- (1996) J. Phys. Chem. , vol.100 , pp. 2535
- Bala, P.¹ Grochowski, P.² Lesyng, B.³ McCammon, J.A.⁴

48
- 11744296705
- To be submitted
- Fang, J.-Y.; Hammes-Schiffer, S. To be submitted.
- Fang, J.-Y.¹ Hammes-Schiffer, S.²

49
- 2242440384
- Tully, J. C.; Preston, R. K. J. Chem. Phys. 1971, 55, 562.
- (1971) J. Chem. Phys. , vol.55 , pp. 562
- Tully, J.C.¹ Preston, R.K.²

50
- 36849103764
- Miller, W. H.; George, T. F. J. Chem. Phys. 1972, 56, 5637.
- (1972) J. Chem. Phys. , vol.56 , pp. 5637
- Miller, W.H.¹ George, T.F.²

51
- 0000810970
- Stine, J. R.; Muckerman, J. T. J. Chem. Phys. 1976, 65, 3975.
- (1976) J. Chem. Phys. , vol.65 , pp. 3975
- Stine, J.R.¹ Muckerman, J.T.²

52
- 33751052200
- Blais, N. C.; Truhlar, D. G. J. Chem. Phys. 1983, 79, 1334.
- (1983) J. Chem. Phys. , vol.79 , pp. 1334
- Blais, N.C.¹ Truhlar, D.G.²

53
- 36549094874
- Blais, N. C.; Truhlar, D. G.; Mead, C. A. J. Chem. Phys. 1988, 89, 6204.
- (1988) J. Chem. Phys. , vol.89 , pp. 6204
- Blais, N.C.¹ Truhlar, D.G.² Mead, C.A.³

54
- 0000498441
- Dunne, L. J.; Murrell, J. N.; Stamper, J. G. Chem. Phys. Lett. 1984, 112, 497.
- (1984) Chem. Phys. Lett. , vol.112 , pp. 497
- Dunne, L.J.¹ Murrell, J.N.² Stamper, J.G.³

55
- 85044497210
- Parlant, G.; Gislason, E. A. J. Chem. Phys. 1989, 91, 4416.
- (1989) J. Chem. Phys. , vol.91 , pp. 4416
- Parlant, G.¹ Gislason, E.A.²

56
- 36549095372
- Parlant, G.; Alexander, M. H. J. Chem. Phys. 1990, 92, 2287.
- (1990) J. Chem. Phys. , vol.92 , pp. 2287
- Parlant, G.¹ Alexander, M.H.²

57
- 0001245214
- Kuntz, P. J. J. Chem. Phys. 1991, 95, 141.
- (1991) J. Chem. Phys. , vol.95 , pp. 141
- Kuntz, P.J.¹

58
- 0001245214
- Kuntz, P. J.; Hogreve, J. J. J. Chem. Phys. 1991, 95, 156.
- (1991) J. Chem. Phys. , vol.95 , pp. 156
- Kuntz, P.J.¹ Hogreve, J.J.²

59
- 36549100281
- Herman, M. F. J. Chem. Phys. 1984, 81, 754.
- (1984) J. Chem. Phys. , vol.81 , pp. 754
- Herman, M.F.¹

60
- 0004490433
- Herman, M. F. J. Chem. Phys. 1984, 81, 764.
- (1984) J. Chem. Phys. , vol.81 , pp. 764
- Herman, M.F.¹

61
- 21344491851
- Herman, M. F.; Arce, J. C. Chem. Phys. 1994, 183, 335.
- (1994) Chem. Phys. , vol.183 , pp. 335
- Herman, M.F.¹ Arce, J.C.²

62
- 36449000819
- Arce, J. C.; Herman, M. F. J. Chem. Phys. 1994, 101, 7520.
- (1994) J. Chem. Phys. , vol.101 , pp. 7520
- Arce, J.C.¹ Herman, M.F.²

63
- 13044304431
- Tully, J. C. J. Chem. Phys. 1990, 93, 1061.
- (1990) J. Chem. Phys. , vol.93 , pp. 1061
- Tully, J.C.¹

64
- 4243952742
- Webster, F. J.; Schnitker, J.; Friedrichs, M. S.; Friesner, R.; Rossky, P. Phys. Rev. Lett. 1991, 66, 3172.
- (1991) Phys. Rev. Lett. , vol.66 , pp. 3172
- Webster, F.J.¹ Schnitker, J.² Friedrichs, M.S.³ Friesner, R.⁴ Rossky, P.⁵

65
- 0026103656
- Webster, F.; Rossky, P. J.; Friesner, R. A. Comput. Phys. Commun. 1991, 63, 494.
- (1991) Comput. Phys. Commun. , vol.63 , pp. 494
- Webster, F.¹ Rossky, P.J.² Friesner, R.A.³

66
- 36448999802
- Webster, F.; Wang, E. T., Rossky, P. J.; Friesner, R. A. J. Chem. Phys. 1994, 100, 4835.
- (1994) J. Chem. Phys. , vol.100 , pp. 4835
- Webster, F.¹ Wang, E.T.² Rossky, P.J.³ Friesner, R.A.⁴

67
- 11744342230
- Space, B.; Coker, D. F. J. Chem. Phys. 1991, 94.
- (1991) J. Chem. Phys. , vol.94
- Space, B.¹ Coker, D.F.²

68
- 0000593564
- Space, B.; Coker, D. F. J. Chem. Phys. 1992, 96, 652.
- (1992) J. Chem. Phys. , vol.96 , pp. 652
- Space, B.¹ Coker, D.F.²

69
- 36449001803
- Coker, D. F.; Xiao, L. J. Chem. Phys. 1995, 102, 496.
- (1995) J. Chem. Phys. , vol.102 , pp. 496
- Coker, D.F.¹ Xiao, L.²

70
- 0003631341
- Kluwer Academic: Dordrecht, The Netherlands
- Coker, D. F. Computer Simulation in Chemical Physics; Kluwer Academic: Dordrecht, The Netherlands, 1993.
- (1993) Computer Simulation in Chemical Physics
- Coker, D.F.¹

71
- 0347855782
- Prezhdo, O. V.; Rossky, P. J. J. Chem. Phys. 1997, 107, 825.
- (1997) J. Chem. Phys. , vol.107 , pp. 825
- Prezhdo, O.V.¹ Rossky, P.J.²

72
- 0007082113
- Topaler, M. S.; Allison, T. C.; Schwenke, D. W.; Truhlar, D. G J. Phys. Chem. A 1998, 102, 1666.
- (1998) J. Phys. Chem. A , vol.102 , pp. 1666
- Topaler, M.S.¹ Allison, T.C.² Schwenke, D.W.³ Truhlar, D.G.⁴

73
- 0026103026
- Makri, N. Comput. Phys. Comm. 1991, 63, 389.
- (1991) Comput. Phys. Comm. , vol.63 , pp. 389
- Makri, N.¹

74
- 36449000739
- Cao, J.; Voth. G. A. J. Chem. Phys. 1993, 99, 10070.
- (1993) J. Chem. Phys. , vol.99 , pp. 10070
- Cao, J.¹ Voth, G.A.²

75
- 36449006832
- Cao, J.; Voth, G. A. J. Chem. Phys. 1994, 100, 5106.
- (1994) J. Chem. Phys. , vol.100 , pp. 5106
- Cao, J.¹ Voth, G.A.²

76
- 36449001194
- Cao, J.; Voth, G. A. J. Chem. Phys. 1994, 101, 6157.
- (1994) J. Chem. Phys. , vol.101 , pp. 6157
- Cao, J.¹ Voth, G.A.²

77
- 36448999242
- Cao, J.; Voth, G. A. J. Chem. Phys. 1994, 101, 6168.
- (1994) J. Chem. Phys. , vol.101 , pp. 6168
- Cao, J.¹ Voth, G.A.²

78
- 0346725548
- Fang, J.-Y.; Hammes-Schiffer, S. J. Chem. Phys. 1997, 107, 8933.
- (1997) J. Chem. Phys. , vol.107 , pp. 8933
- Fang, J.-Y.¹ Hammes-Schiffer, S.²

79
- 0001655653
- Hammes-Schiffer, S. J. Chem. Phys. 1996, 105, 2236.
- (1996) J. Chem. Phys. , vol.105 , pp. 2236
- Hammes-Schiffer, S.¹

80
- 0001135254
- Drukker, K.; Hammes-Schiffer, S. J. Chem. Phys. 1997, 107, 363.
- (1997) J. Chem. Phys. , vol.107 , pp. 363
- Drukker, K.¹ Hammes-Schiffer, S.²

81
- 11744261925
- in press
- Soudackov, A. V.; Hammes-Schiffer, S. Chem. Phys. Lett., in press.
- Chem. Phys. Lett.
- Soudackov, A.V.¹ Hammes-Schiffer, S.²

82
- 0000378981
- Kotler, Z.; Nitzan, A.; Kosloff, R. Chem. Phys. Lett. 1988, 153, 483.
- (1988) Chem. Phys. Lett. , vol.153 , pp. 483
- Kotler, Z.¹ Nitzan, A.² Kosloff, R.³

83
- 33749091924
- Campos-Martinez, J.; Waldeck, J. R.; Coalson, R. D. J. Chem. Phys. 1992, 96, 3613.
- (1992) J. Chem. Phys. , vol.96 , pp. 3613
- Campos-Martinez, J.¹ Waldeck, J.R.² Coalson, R.D.³

84
- 0031585972
- Morelli, J.; Hammes-Schiffer, S. Chem. Phys. Lett. 1997, 269, 161.
- (1997) Chem. Phys. Lett. , vol.269 , pp. 161
- Morelli, J.¹ Hammes-Schiffer, S.²

85
- 0242510121
- Tal-Ezer, H.; Kosloff, R. J. Chem. Phys. 1984, 81, 3967.
- (1984) J. Chem. Phys. , vol.81 , pp. 3967
- Tal-Ezer, H.¹ Kosloff, R.²

86
- 0030126484
- Schwanz, B. J.; Bittner, E. R.; Prezhdo, O. V.; Rossky, P. J. J. Chem. Phys. 1996, 104, 5942.
- (1996) J. Chem. Phys. , vol.104 , pp. 5942
- Schwanz, B.J.¹ Bittner, E.R.² Prezhdo, O.V.³ Rossky, P.J.⁴

87
- 36449001385
- Bittner, E. R.; Rossky, P. J. J. Chem. Phys. 1995, 103, 8130.
- (1995) J. Chem. Phys. , vol.103 , pp. 8130
- Bittner, E.R.¹ Rossky, P.J.²

88
- 36049058509
- Pechukas, P. Phys. Rev. 1969, 181, 174.
- (1969) Phys. Rev. , vol.181 , pp. 174
- Pechukas, P.¹

89
- 33244489682
- Neria, E.; Nitzan, A. J. Chem. Phys. 1993, 99, 1109.
- (1993) J. Chem. Phys. , vol.99 , pp. 1109
- Neria, E.¹ Nitzan, A.²

90
- 0010866089
- Jungwirth, P.; Gerber, R. B. J. Chem. Phys. 1996, 104, 5803.
- (1996) J. Chem. Phys. , vol.104 , pp. 5803
- Jungwirth, P.¹ Gerber, R.B.²

91
- 0010930905
- Martinez, T. J.; Ben-Nun, M.; Levine, R. D. J. Phys. Chem. 1996, 100, 0, 7884.
- (1996) J. Phys. Chem. , vol.100 , pp. 7884
- Martinez, T.J.¹ Ben-Nun, M.² Levine, R.D.³

92
- 33745014742
- Wigner, E. Phys. Rev. 1932, 40, 749.
- (1932) Phys. Rev. , vol.40 , pp. 749
- Wigner, E.¹

93
- 36749116312
- Heller, E. J. J. Chem. Phys. 1976, 65, 1289.
- (1976) J. Chem. Phys. , vol.65 , pp. 1289
- Heller, E.J.¹

94
- 0000694595
- Keck, J. C. J. Chem. Phys. 1960, 32, 1035.
- (1960) J. Chem. Phys. , vol.32 , pp. 1035
- Keck, J.C.¹

95
- 36849097384
- Anderson, J. B. J. Chem. Phys. 1973, 58, 4684.
- (1973) J. Chem. Phys. , vol.58 , pp. 4684
- Anderson, J.B.¹

96
- 0003852362
- American Chemical Society: Washington, DC
- Bennett, C. H. Algorithms for Chemical Computation; American Chemical Society: Washington, DC, 1997.
- (1997) Algorithms for Chemical Computation
- Bennett, C.H.¹

97
- 36448998861
- Hammes-Schiffer, S.; Tully, J. C. J. Chem. Phys. 1995, 103, 8528.
- (1995) J. Chem. Phys. , vol.103 , pp. 8528
- Hammes-Schiffer, S.¹ Tully, J.C.²

98
- 0007026399
- Tobin, F. L.; Bowman, J. M. Chem. Phys. 1980, 47, 151.
- (1980) Chem. Phys. , vol.47 , pp. 151
- Tobin, F.L.¹ Bowman, J.M.²

99
- 0001685342
- Applications of Electronic Structure Theory
- Plenum Press: New York
- Pulay, P. Applications of Electronic Structure Theory; Modern Theoretical Chemistry; Plenum Press: New York, 1977; Vol. 4.
- (1977) Modern Theoretical Chemistry , vol.4
- Pulay, P.¹

100
- 0001187720
- Orukker, K.; de Leeuw, S.; Hammes-Schiffer, S. J. Chem. Phys. 1998, 108, 6799.
- (1998) J. Chem. Phys. , vol.108 , pp. 6799
- Orukker, K.¹ De Leeuw, S.² Hammes-Schiffer, S.³

101
- 0000534429
- Duan, X.; Schemer, S. J. Mol. Struct. 1992, 270, 173.
- (1992) J. Mol. Struct. , vol.270 , pp. 173
- Duan, X.¹ Schemer, S.²

102
- 0001425244
- Cheng, H.-P.; Barnett, R. N.; Landman, U. Chem. Phys. Lett. 1995, 237, 161.
- (1995) Chem. Phys. Lett. , vol.237 , pp. 161
- Cheng, H.-P.¹ Barnett, R.N.² Landman, U.³

103
- 0000135791
- Tuckerman, M.; Laasonen, K.; Sprik, M.; Parrinello, M. J. Chem. Phys. 1995, 103, 150.
- (1995) J. Chem. Phys. , vol.103 , pp. 150
- Tuckerman, M.¹ Laasonen, K.² Sprik, M.³ Parrinello, M.⁴

104
- 0031034836
- Tuckerman, M. E.; Marx, D.; Klein, M. L.; Parrinello, M. Science 1997, 275, 817.
- (1997) Science , vol.275 , pp. 817
- Tuckerman, M.E.¹ Marx, D.² Klein, M.L.³ Parrinello, M.⁴

105
- 59949093144
- Kreuer, K.-D. Chem. Mater. 1996, 8, 610.
- (1996) Chem. Mater. , vol.8 , pp. 610
- Kreuer, K.-D.¹

106
- 0000958735
- Schmidt, R. G.; Brickmann, J. Ber. Bunsen-Ges. Phys. Chem. 1997, 101, 1816.
- (1997) Ber. Bunsen-Ges. Phys. Chem. , vol.101 , pp. 1816
- Schmidt, R.G.¹ Brickmann, J.²

107
- 11744384413
- Agmon, N. Chem. Phys. Lett. 1995, 244, 456.
- (1995) Chem. Phys. Lett. , vol.244 , pp. 456
- Agmon, N.¹

108
- 0032548589
- Vuilleumier, R.; Borgis, D. Chem. Phys. Lett. 1998, 284, 71.
- (1998) Chem. Phys. Lett. , vol.284 , pp. 71
- Vuilleumier, R.¹ Borgis, D.²

109
- 0347356002
- Vuilleumier, R.; Borgis, D. J. Phys. Chem. B 1998, 102, 4261.
- (1998) J. Phys. Chem. B , vol.102 , pp. 4261
- Vuilleumier, R.¹ Borgis, D.²

110
- 11644271492
- Schmitt, U.; Voth, G. A. J. Phys. Chem. B 1998, 102, 5547.
- (1998) J. Phys. Chem. B , vol.102 , pp. 5547
- Schmitt, U.¹ Voth, G.A.²

111
- 36749115718
- Stillinger, F. H.; David, C. W. J. Chem. Phys. 1978, 69, 1473.
- (1978) J. Chem. Phys. , vol.69 , pp. 1473
- Stillinger, F.H.¹ David, C.W.²

112
- 0001375333
- Weber, T. A.; Stillinger, F. H. J. Phys. Chem. 1982, 86, 1314.
- (1982) J. Phys. Chem. , vol.86 , pp. 1314
- Weber, T.A.¹ Stillinger, F.H.²

113
- 0001296204
- Stillinger, F. H. J. Chem. Phys. 1979, 71, 1647.
- (1979) J. Chem. Phys. , vol.71 , pp. 1647
- Stillinger, F.H.¹

114
- 11744300211
- To be submitted
- Decernez, H.; Drukker, K. D.; Hammes-Schiffer, S. To be submitted.
- Decernez, H.¹ Drukker, K.D.² Hammes-Schiffer, S.³

115
- 4243406978
- Fang, J.-Y.; Hammes-Schiffer, S. J. Chem. Phys. 1997, 106, 8442.
- (1997) J. Chem. Phys. , vol.106 , pp. 8442
- Fang, J.-Y.¹ Hammes-Schiffer, S.²

116
- 0031244678
- Fang, J.-Y.; Hammes-Schiffer, S. J. Chem. Phys. 1997, 107, 5727.
- (1997) J. Chem. Phys. , vol.107 , pp. 5727
- Fang, J.-Y.¹ Hammes-Schiffer, S.²

117
- 33751158124
- Cukier, R. I. J. Phys. Chem. 1994, 98, 2377.
- (1994) J. Phys. Chem. , vol.98 , pp. 2377
- Cukier, R.I.¹

118
- 0000012384
- Zhao, X. G.; Cukier, R. I. J. Phys. Chem. 1995, 99, 945.
- (1995) J. Phys. Chem. , vol.99 , pp. 945
- Zhao, X.G.¹ Cukier, R.I.²

119
- 0001077676
- Cukier, R. I. J. Phys. Chem. 1995, 99, 16101.
- (1995) J. Phys. Chem. , vol.99 , pp. 16101
- Cukier, R.I.¹

120
- 33748381480
- Cukier, R. I. J. Phys. Chem. 1996, 100, 15428.
- (1996) J. Phys. Chem. , vol.100 , pp. 15428
- Cukier, R.I.¹

121
- 5344232863
- Turro, C.; Chang, C. K.; Leroi, G. E.; Cukier, R. I.; Nocera, D. G. J. Am. Chem. Soc. 1992, 114, 4013.
- (1992) J. Am. Chem. Soc. , vol.114 , pp. 4013
- Turro, C.¹ Chang, C.K.² Leroi, G.E.³ Cukier, R.I.⁴ Nocera, D.G.⁵

122
- 0007083260
- Roberts, J. A.; Kirby, J. P.; Nocera, D. G. J. Am. Chem. Soc. 1995, 117, 8051.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 8051
- Roberts, J.A.¹ Kirby, J.P.² Nocera, D.G.³

123
- 0031260356
- Kirby, J. P.; Roberts, J. A.; Nocera, D. G. J. Am. Chem. Soc. 1997, 119, 9230.
- (1997) J. Am. Chem. Soc. , vol.119 , pp. 9230
- Kirby, J.P.¹ Roberts, J.A.² Nocera, D.G.³

124
- 0001889592
- JAI Press Inc.: London
- Hammes-Schiffer, S. Advances in Classical Trajectory Methods; JAI Press Inc.: London, 1998; Vol. 3, pp 73-119.
- (1998) Advances in Classical Trajectory Methods , vol.3 , pp. 73-119
- Hammes-Schiffer, S.¹

125
- 0000748902
- Herman, M. F. J. Chem. Phys. 1995, 103, 8081.
- (1995) J. Chem. Phys. , vol.103 , pp. 8081
- Herman, M.F.¹

126
- 0041361416
- Sun, X.; Miller, W. H. J. Chem. Phys. 1997, 106, 6346.
- (1997) J. Chem. Phys. , vol.106 , pp. 6346
- Sun, X.¹ Miller, W.H.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.