-
1
-
-
0000872554
-
-
Dunning, T. H., Jr.; Hording, L. B.; Wagner, A. F.; Schatz, G. C.; Bowman, J. M. Science 1988, 240, 453-459.
-
(1988)
Science
, vol.240
, pp. 453-459
-
-
Dunning Jr., T.H.1
Hording, L.B.2
Wagner, A.F.3
Schatz, G.C.4
Bowman, J.M.5
-
3
-
-
0032508112
-
-
Angell, A. Nature 1998, 393, 521-524.
-
(1998)
Nature
, vol.393
, pp. 521-524
-
-
Angell, A.1
-
5
-
-
0032552138
-
-
Wales, D. J.; Miller, M. A.; Walsh, T. R. Nature 1998, 394, 758-760.
-
(1998)
Nature
, vol.394
, pp. 758-760
-
-
Wales, D.J.1
Miller, M.A.2
Walsh, T.R.3
-
6
-
-
0001432896
-
Dynamical Formulation of Transition State Theory: Variational Transition States and Semiclassical Tunneling
-
Bertrán, J., Csizmadia, I. G., Eds.; NATO ASI Series C 267; Kluwer: Dordrecht, The Netherlands
-
Tucker, S. C.; Truhlar, D. G. Dynamical Formulation of Transition State Theory: Variational Transition States and Semiclassical Tunneling. In New Theoretical Concepts for Understanding Organic Reactions; Bertrán, J., Csizmadia, I. G., Eds.; NATO ASI Series C 267; Kluwer: Dordrecht, The Netherlands, 1989; pp 291-346.
-
(1989)
New Theoretical Concepts for Understanding Organic Reactions
, pp. 291-346
-
-
Tucker, S.C.1
Truhlar, D.G.2
-
7
-
-
0002000203
-
Generalized Transition State Theory
-
Baer, M., Ed.; CRC Press: Boca Raton, FL
-
Truhlar, D. G.; Isaacson, A. D.; Garrett, B. C. Generalized Transition State Theory. In Theory of Chemical Reaction Dynamics; Baer, M., Ed.; CRC Press: Boca Raton, FL, 1985; pp 65-137.
-
(1985)
Theory of Chemical Reaction Dynamics
, pp. 65-137
-
-
Truhlar, D.G.1
Isaacson, A.D.2
Garrett, B.C.3
-
8
-
-
0003771874
-
-
Advances in Chemical Physics; John Wiley & Sons, Inc.: New York
-
Benderskii, V. A.; Makarov, D. E.; Wight, C. A. Chemical Dynamics at Low Temperatures; Advances in Chemical Physics; John Wiley & Sons, Inc.: New York, 1994; Vol. 88.
-
(1994)
Chemical Dynamics at Low Temperatures
, vol.88
-
-
Benderskii, V.A.1
Makarov, D.E.2
Wight, C.A.3
-
9
-
-
0001049015
-
-
Liu, Y.-P.; Lu, D.-h.; Gonzalez-Lafont, A.; Truhlar, D. G.; Garrett, B. C. J. Am. Chem. Soc. 1993, 115, 7806-7817.
-
(1993)
J. Am. Chem. Soc.
, vol.115
, pp. 7806-7817
-
-
Liu, Y.-P.1
Lu, D.-H.2
Gonzalez-Lafont, A.3
Truhlar, D.G.4
Garrett, B.C.5
-
10
-
-
0001037022
-
-
Loerting, T.; Liedl, K. R.; Rode, B. M. J. Chem. Phys. 1998, 109, 2672-2679.
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 2672-2679
-
-
Loerting, T.1
Liedl, K.R.2
Rode, B.M.3
-
13
-
-
0032554077
-
-
Loerting, T.; Liedl, K. R.; Rode, B. M. J. Am. Chem. Soc. 1998, 120, 404-412.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 404-412
-
-
Loerting, T.1
Liedl, K.R.2
Rode, B.M.3
-
14
-
-
33845551595
-
-
Truhlar, D. G.; Hase, W. L.; Hynes, J. T. J. Phys. Chem. 1983, 87, 2664-2682.
-
(1983)
J. Phys. Chem.
, vol.87
, pp. 2664-2682
-
-
Truhlar, D.G.1
Hase, W.L.2
Hynes, J.T.3
-
17
-
-
0001863950
-
Transition State Theory
-
Bernasconi, C. F., Ed.; John Wiley & Sons, Inc.: New York
-
Kreevoy, M. M.; Truhlar, D. G. Transition State Theory. In Investigation of Rates and Mechanisms of Reactions; Bernasconi, C. F., Ed.; John Wiley & Sons, Inc.: New York, 1986; pp 13-95.
-
(1986)
Investigation of Rates and Mechanisms of Reactions
, pp. 13-95
-
-
Kreevoy, M.M.1
Truhlar, D.G.2
-
18
-
-
0002753774
-
-
Formosinho, S. J., et al., Eds.; NATO ASI Series C 339; Kluwer Academic: The Netherlands
-
Garrett, B. C.; Melius, C. F. In Theoretical and Computational Models for Organic Chemistry; Formosinho, S. J., et al., Eds.; NATO ASI Series C 339; Kluwer Academic: The Netherlands, 1991; pp 35-54.
-
(1991)
Theoretical and Computational Models for Organic Chemistry
, pp. 35-54
-
-
Garrett, B.C.1
Melius, C.F.2
-
19
-
-
0030218764
-
-
Truhlar, D. G.; Garrett, B. C.; Klippenstein, S. J. J. Phys. Chem. 1996, 100, 12771-12800.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 12771-12800
-
-
Truhlar, D.G.1
Garrett, B.C.2
Klippenstein, S.J.3
-
22
-
-
0031211396
-
-
Guo, Y.; Li, S.; Thompson, D. L. J. Chem. Phys. 1997, 107, 2853-2858.
-
(1997)
J. Chem. Phys.
, vol.107
, pp. 2853-2858
-
-
Guo, Y.1
Li, S.2
Thompson, D.L.3
-
29
-
-
0007082113
-
-
Topaler, M. S.; Allison, T. C.; Schwenke, D. W.; Truhlar, D. G. J. Phys. Chem. A 1998, 102, 1666-1673.
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 1666-1673
-
-
Topaler, M.S.1
Allison, T.C.2
Schwenke, D.W.3
Truhlar, D.G.4
-
30
-
-
0001762959
-
-
Corchado, J. C.; Coitifio, E. L.; Chuang, Y.-Y.; Fast, P. L.; Truhlar, D. G. J. Phys. Chem. A 1998, 102, 2424-2438.
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 2424-2438
-
-
Corchado, J.C.1
Coitifio, E.L.2
Chuang, Y.-Y.3
Fast, P.L.4
Truhlar, D.G.5
-
31
-
-
0842333499
-
-
Fernández-Ramos, A.; Rodríguez-Otero, J.; Ríbs, M. A. J. Phys. Chem. A 1998, 102, 2954-2961.
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 2954-2961
-
-
Fernández-Ramos, A.1
Rodríguez-Otero, J.2
Ríbs, M.A.3
-
32
-
-
0000729781
-
-
Dellago, C.; Bolhuis, P. G.; Csajka, F. S.; Chandler, D. J. Chem. Phys. 1998, 108, 1964-1977.
-
(1998)
J. Chem. Phys.
, vol.108
, pp. 1964-1977
-
-
Dellago, C.1
Bolhuis, P.G.2
Csajka, F.S.3
Chandler, D.4
-
33
-
-
0003629390
-
-
University of Minnesota: Minneapolis, MN
-
Chuang, Y.-Y.; Corchado, J. C.; Fast, P. L.; Villá, J.; Coitiño, E. L.; Hu, W.-P.; Liu, Y.-P.; Lynch, G. C.; Nguyen, K. A.; Jackels, C. F.; Gu, M. Z.; Rossi, I.; Clayton, S.; Melissas, V. S.; Steckler, R.; Garrett, B. C.; Isaacson, A. D.; Truhlar, D. G. POLYRATE-version 8.0; University of Minnesota: Minneapolis, MN, 1998.
-
(1998)
POLYRATE-version 8.0
-
-
Chuang, Y.-Y.1
Corchado, J.C.2
Fast, P.L.3
Villá, J.4
Coitiño, E.L.5
Hu, W.-P.6
Liu, Y.-P.7
Lynch, G.C.8
Nguyen, K.A.9
Jackels, C.F.10
Gu, M.Z.11
Rossi, I.12
Clayton, S.13
Melissas, V.S.14
Steckler, R.15
Garrett, B.C.16
Isaacson, A.D.17
Truhlar, D.G.18
-
34
-
-
84964933682
-
-
Gaussian, Inc.: Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B. G.; Chen, W.; Wong, M. W.; Andres, J. L.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, Revision A.4; Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98, Revision A.4
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery, J.A.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Gonzalez, C.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.G.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Head-Gordon, M.55
Replogle, E.S.56
Pople, J.A.57
more..
-
35
-
-
0041740386
-
-
University of Minnesota: Minneapolis, MN
-
Corchado, J. C.; Coitiño, E. L.; Chuang, Y.-Y.; Truhlar, D. G. Gaussrate8.0; University of Minnesota: Minneapolis, MN, 1998.
-
(1998)
Gaussrate8.0
-
-
Corchado, J.C.1
Coitiño, E.L.2
Chuang, Y.-Y.3
Truhlar, D.G.4
-
37
-
-
33846222166
-
-
Melissas, V. S.; Truhlar, D. G.; Garrett, B. C. J. Chem. Phys. 1992, 96, 5758-5772.
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 5758-5772
-
-
Melissas, V.S.1
Truhlar, D.G.2
Garrett, B.C.3
-
39
-
-
33845555998
-
-
Skodje, R. T.; Truhlar, D. G.; Garrett, B. C. J. Phys. Chem. 1981, 85, 3019-3023.
-
(1981)
J. Phys. Chem.
, vol.85
, pp. 3019-3023
-
-
Skodje, R.T.1
Truhlar, D.G.2
Garrett, B.C.3
-
40
-
-
0242314685
-
-
Skodje, R. T.; Truhlar, D. G.; Garrett, B. C. J. Chem. Phys. 1982, 77, 5955-5976.
-
(1982)
J. Chem. Phys.
, vol.77
, pp. 5955-5976
-
-
Skodje, R.T.1
Truhlar, D.G.2
Garrett, B.C.3
-
42
-
-
0001046057
-
-
Garrett, B. C.; Joseph, T.; Truong, T. N.; Truhlar, D. G. Chem. Phys. 1989, 136, 271-283.
-
(1989)
Chem. Phys.
, vol.136
, pp. 271-283
-
-
Garrett, B.C.1
Joseph, T.2
Truong, T.N.3
Truhlar, D.G.4
-
43
-
-
0001227051
-
-
Lynch, G. C.; Truhlar, D. G.; Garrett, B. C. J. Chem. Phys. 1989, 90, 3102-3109.
-
(1989)
J. Chem. Phys.
, vol.90
, pp. 3102-3109
-
-
Lynch, G.C.1
Truhlar, D.G.2
Garrett, B.C.3
-
44
-
-
0345811545
-
-
Märker, C.; Schleyer, P. v. R.; Liedl, K. R.; Ha, T.-K.; Quack, M.; Suhm, M. A. J. Comput. Chem. 1997, 18, 1695-1719.
-
(1997)
J. Comput. Chem.
, vol.18
, pp. 1695-1719
-
-
Märker, C.1
Schleyer, P.V.R.2
Liedl, K.R.3
Ha, T.-K.4
Quack, M.5
Suhm, M.A.6
-
45
-
-
0031170539
-
-
Liedl, K. R.; Sekusak, S.; Kroemer, R. T.; Rode, B. M. J. Phys. Chem. A 1997, 101, 4707-4716.
-
(1997)
J. Phys. Chem. A
, vol.101
, pp. 4707-4716
-
-
Liedl, K.R.1
Sekusak, S.2
Kroemer, R.T.3
Rode, B.M.4
-
46
-
-
0001555303
-
-
Hu, W.-P.; Liu, Y.-R; Truhlar, D. G. J. Chem. Soc., Faraday Trans. 1994, 90, 1715-1725.
-
(1994)
J. Chem. Soc., Faraday Trans.
, vol.90
, pp. 1715-1725
-
-
Hu, W.-P.1
Liu, Y.-R.2
Truhlar, D.G.3
-
47
-
-
36148982195
-
-
Nguyen, K. A.; Rossi, I.; Truhlar, D. G. J. Chem. Phys. 1995, 103, 5522-5530.
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 5522-5530
-
-
Nguyen, K.A.1
Rossi, I.2
Truhlar, D.G.3
-
49
-
-
4243125018
-
-
Baldridge, K. K.; Gordon, M. S.; Steckler, R.; Truhlar, D. G. J. Phys. Chem. 1989, 93, 5107-5119.
-
(1989)
J. Phys. Chem.
, vol.93
, pp. 5107-5119
-
-
Baldridge, K.K.1
Gordon, M.S.2
Steckler, R.3
Truhlar, D.G.4
-
50
-
-
0000775656
-
Direct Dynamics Method for the Calculation of Reaction Rates
-
Heidrich, D., Ed.; Kluwer: Dordrecht
-
Truhlar, D. G. Direct Dynamics Method for the Calculation of Reaction Rates. In The Reaction Path in Chemistry: Current Approaches and Perspectives; Heidrich, D., Ed.; Kluwer: Dordrecht, 1995; pp 229-255.
-
(1995)
The Reaction Path in Chemistry: Current Approaches and Perspectives
, pp. 229-255
-
-
Truhlar, D.G.1
-
51
-
-
0029193596
-
-
Corchado, J. C.; Espinosa-Garcia, J.; Hu, W.-P.; Rossi, I.; Truhlar, D. G. J. Phys. Chem. 1995, 99, 687-694.
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 687-694
-
-
Corchado, J.C.1
Espinosa-Garcia, J.2
Hu, W.-P.3
Rossi, I.4
Truhlar, D.G.5
-
54
-
-
0006894658
-
-
Roberto-Neto, O.; Coitiño, E. L.; Truhlar, D. G. J. Phys. Chem. A 1998, 102, 4568-4578.
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 4568-4578
-
-
Roberto-Neto, O.1
Coitiño, E.L.2
Truhlar, D.G.3
-
55
-
-
0001283274
-
-
Corchado, J. C.; Espinosa-García, J.; Roberto-Neto, O.; Chuang, Y.-Y.; Truhlar, D. G. J. Phys. Chem. A 1998, 102, 4899-4910.
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 4899-4910
-
-
Corchado, J.C.1
Espinosa-García, J.2
Roberto-Neto, O.3
Chuang, Y.-Y.4
Truhlar, D.G.5
-
56
-
-
0032486786
-
-
Fernández-Ramos, A.; Martínez-Núñez, E.; Ríos, M. A.; RodríguezOtero, J.; Vázquez, S. A.; Estévez, C. M. J. Am. Chem. Soc. 1998, 120, 7594-7601.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 7594-7601
-
-
Fernández-Ramos, A.1
Martínez-Núñez, E.2
Ríos, M.A.3
Rodríguezotero, J.4
Vázquez, S.A.5
Estévez, C.M.6
-
57
-
-
0000466966
-
-
Smedarchina, Z.; Siebrand, W.; Zgierski, M. Z. J. Chem. Phys. 1995, 103, 5326-5334.
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 5326-5334
-
-
Smedarchina, Z.1
Siebrand, W.2
Zgierski, M.Z.3
-
58
-
-
5344227232
-
-
Smedarchina, Z.; Siebrand, W.; Zgierski, M. Z. J. Chem. Phys. 1996, 104, 1203-1212.
-
(1996)
J. Chem. Phys.
, vol.104
, pp. 1203-1212
-
-
Smedarchina, Z.1
Siebrand, W.2
Zgierski, M.Z.3
-
59
-
-
0000614245
-
-
Smedarchina, Z.; Fernandez-Ramos, A.; Rios, M. A. J. Chem. Phys. 1997, 100, 3956-3964.
-
(1997)
J. Chem. Phys.
, vol.100
, pp. 3956-3964
-
-
Smedarchina, Z.1
Fernandez-Ramos, A.2
Rios, M.A.3
-
60
-
-
0000223789
-
-
Smedarchina, Z.; Zgierski, M. Z.; Siebrand, W.; Kozlowski, P. M. J. Chem. Phys. 1998, 109, 1014-1024.
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 1014-1024
-
-
Smedarchina, Z.1
Zgierski, M.Z.2
Siebrand, W.3
Kozlowski, P.M.4
-
61
-
-
0013424080
-
-
Fernández-Ramos, A.; Smedarchina, Z.; Zgierski, M. Z.; Siebrand, W. J. Chem. Phys. 1998, 109, 1004-1013.
-
(1998)
Chem. Phys.
, vol.109
, pp. 1004-1013
-
-
Fernández-Ramos, A.1
Smedarchina, Z.2
Zgierski, M.Z.3
Siebrand, W.J.4
-
62
-
-
0000461001
-
-
Smedarchina, Z.; Caminati, W.; Zerbetto, F. Chem. Phys. Lett. 1995, 257, 279-285.
-
(1995)
Chem. Phys. Lett.
, vol.257
, pp. 279-285
-
-
Smedarchina, Z.1
Caminati, W.2
Zerbetto, F.3
-
63
-
-
0031184735
-
-
Benderskii, V. A.; Vetoshkin, E. V.; Grebenshchikov, S. Y.; von Laue, L.; Trommsdorff, H. P. Chem. Phys. 1997, 279, 119-142.
-
(1997)
Chem. Phys.
, vol.279
, pp. 119-142
-
-
Benderskii, V.A.1
Vetoshkin, E.V.2
Grebenshchikov, S.Y.3
Von Laue, L.4
Trommsdorff, H.P.5
-
67
-
-
0000535730
-
-
Liedl, K. R.; Kroemer, R. T.; Rode, B. M. Chem. Phys. Lett. 1995, 246, 455-462.
-
(1995)
Chem. Phys. Lett.
, vol.246
, pp. 455-462
-
-
Liedl, K.R.1
Kroemer, R.T.2
Rode, B.M.3
-
70
-
-
0001416980
-
N
-
Conceptual Trends in Quantum Chemistry; Kluwer Publishing Co.: Dordrecht
-
N. In Conceptual Perspectives in Quantum Chemistry; Conceptual Trends in Quantum Chemistry; Kluwer Publishing Co.: Dordrecht, 1997; Vol. 3, pp 417-467.
-
(1997)
Conceptual Perspectives in Quantum Chemistry
, vol.3
, pp. 417-467
-
-
Quack, M.1
Suhm, M.A.2
-
71
-
-
0001173971
-
-
Klopper, W.; Quack, M.; Suhm, M. A. Mol. Phys. 1998, 94, 105-119.
-
(1998)
Mol. Phys.
, vol.94
, pp. 105-119
-
-
Klopper, W.1
Quack, M.2
Suhm, M.A.3
-
72
-
-
0347073015
-
Case Studies on Cooperativity in Hydrogen Bonded Clusters and Polymers: Neutral Chain-like and Cyclic Clusters of Hydrogen Fluoride and Hydrogen Cyanide and Charged Defects on Chain-like Hydrogen Fluoride Oligomers
-
Scheiner, S., Ed.; Wiley: Chichester, UK
-
Karpfen, A. Case Studies on Cooperativity in Hydrogen Bonded Clusters and Polymers: Neutral Chain-like and Cyclic Clusters of Hydrogen Fluoride and Hydrogen Cyanide and Charged Defects on Chain-like Hydrogen Fluoride Oligomers. In Molecular Interactions-From van der Waals to Strongly Bound Complexes; Scheiner, S., Ed.; Wiley: Chichester, UK, 1997; pp 265-296.
-
(1997)
Molecular Interactions-From Van Der Waals to Strongly Bound Complexes
, pp. 265-296
-
-
Karpfen, A.1
-
76
-
-
36549101035
-
-
Wang, X.; Jin, Y. G.; Suto, M.; Lee, L. C. J. Chem. Phys. 1988, 89, 4853-4860.
-
(1988)
J. Chem. Phys.
, vol.89
, pp. 4853-4860
-
-
Wang, X.1
Jin, Y.G.2
Suto, M.3
Lee, L.C.4
-
79
-
-
0000233184
-
-
Kolb, C. E.; Jayne, J. T.; Worsnop, D. R.; Molina, M. J.; Meads, R. F.; Viggiano, A. A. J. Am. Chem. Soc. 1994, 116, 10314-10315.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 10314-10315
-
-
Kolb, C.E.1
Jayne, J.T.2
Worsnop, D.R.3
Molina, M.J.4
Meads, R.F.5
Viggiano, A.A.6
-
81
-
-
0001551889
-
-
Arstila, H.; Laasonen, K.; Laaksonen, A. J. Chem. Phys. 1998, 108, 1031-1039.
-
(1998)
J. Chem. Phys.
, vol.108
, pp. 1031-1039
-
-
Arstila, H.1
Laasonen, K.2
Laaksonen, A.3
-
84
-
-
0032026128
-
-
Bianco, R.; Gertner, B. J.; Hynes, J. T. Ber. Bunsen.-Ges. Phys. Chem. 1998, 102, 518-526.
-
(1998)
Ber. Bunsen.-Ges. Phys. Chem.
, vol.102
, pp. 518-526
-
-
Bianco, R.1
Gertner, B.J.2
Hynes, J.T.3
-
90
-
-
0024397507
-
-
Merz, K. M., Jr.; Hoffmann, R.; Dewar, M. J. S. J. Am. Chem. Soc. 1989, 111, 5636-5649.
-
(1989)
J. Am. Chem. Soc.
, vol.111
, pp. 5636-5649
-
-
Merz Jr., K.M.1
Hoffmann, R.2
Dewar, M.J.S.3
-
93
-
-
0032510965
-
-
Gennis, R. B. Science 1998, 280, 1712-1713.
-
(1998)
Science
, vol.280
, pp. 1712-1713
-
-
Gennis, R.B.1
-
94
-
-
18144447465
-
-
Yoshikawa, S.; Shinzawa-Itoh, K.; Nakashima, R.; Yaono, R.; Yamashita, E.; Inoue, N.; Yao, M.; Fei, M. J.; Libeu, C. P.; Mizushima, T.; Yamaguchi, H.; Tomizaki, T.; Tsukihara, T. Science 1998, 280, 1723-1729.
-
(1998)
Science
, vol.280
, pp. 1723-1729
-
-
Yoshikawa, S.1
Shinzawa-Itoh, K.2
Nakashima, R.3
Yaono, R.4
Yamashita, E.5
Inoue, N.6
Yao, M.7
Fei, M.J.8
Libeu, C.P.9
Mizushima, T.10
Yamaguchi, H.11
Tomizaki, T.12
Tsukihara, T.13
-
96
-
-
0032549731
-
-
Gai, F.; Hasson, K. C.; McDonald, J. C.; Anfinrud, P. A. Science 1998, 279, 1886-1891.
-
(1998)
Science
, vol.279
, pp. 1886-1891
-
-
Gai, F.1
Hasson, K.C.2
McDonald, J.C.3
Anfinrud, P.A.4
-
97
-
-
0032546920
-
-
Luecke, H.; Richter, H.-T.; Lanyi, J. K. Science 1998, 280, 1934-1937.
-
(1998)
Science
, vol.280
, pp. 1934-1937
-
-
Luecke, H.1
Richter, H.-T.2
Lanyi, J.K.3
-
98
-
-
0032538783
-
-
Guo, H.; Salahub, D. R. Angew. Chem., Int. Ed. 1998, 37, 2985-2990.
-
(1998)
Angew. Chem., Int. Ed.
, vol.37
, pp. 2985-2990
-
-
Guo, H.1
Salahub, D.R.2
-
99
-
-
0033577309
-
-
Toba, S.; Colombo, G.; Merz, K. M., Jr. J. Am. Chem. Soc. 1999, 121, 2290-2302.
-
(1999)
J. Am. Chem. Soc.
, vol.121
, pp. 2290-2302
-
-
Toba, S.1
Colombo, G.2
Merz Jr., K.M.3
-
100
-
-
0033577286
-
-
Denisov, V. P.; Jonsson, B.-H.; Halle, B. J. Am. Chem. Soc. 1999, 121, 2327-2328.
-
(1999)
J. Am. Chem. Soc.
, vol.121
, pp. 2327-2328
-
-
Denisov, V.P.1
Jonsson, B.-H.2
Halle, B.3
-
103
-
-
0031034836
-
-
Tuckerman, M. E.; Marx, D.; Klein, M. L.; Parrinello, M. Science 1997, 275, 817-820.
-
(1997)
Science
, vol.275
, pp. 817-820
-
-
Tuckerman, M.E.1
Marx, D.2
Klein, M.L.3
Parrinello, M.4
-
105
-
-
0033580290
-
-
Marx, D.; Tuckerman, M. E.; Hutter, J.; Parrinello, M. Nature 1999, 397, 601-604.
-
(1999)
Nature
, vol.397
, pp. 601-604
-
-
Marx, D.1
Tuckerman, M.E.2
Hutter, J.3
Parrinello, M.4
-
106
-
-
0033580270
-
-
Hynes, J. T. Nature 1999, 397, 565-566.
-
(1999)
Nature
, vol.397
, pp. 565-566
-
-
Hynes, J.T.1
-
107
-
-
0000609352
-
-
Decornez, H.; Drukker, K.; Hammes-Schiffer, S. J. Phys. Chem. A 1999, 103, 2891-2898.
-
(1999)
J. Phys. Chem. A
, vol.103
, pp. 2891-2898
-
-
Decornez, H.1
Drukker, K.2
Hammes-Schiffer, S.3
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