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Physical Chemistry Chemical Physics

Volumn 2, Issue 4, 2000, Pages 793-803

A master equation model for bimolecular reaction via multi-well isomerizing intermediates

(4) Frankcombe, Terry J a Smith, Sean C a Gates, Kevin E a Robertson, Struan H b

a UNIVERSITY OF QUEENSLAND (Australia)

b Molecular Simulations Inc (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; CALCULATION; CHEMICAL REACTION; ISOMERISM; MOLECULAR INTERACTION; PRESSURE; TEMPERATURE;

EID: 0034651262 PISSN: 14639076 EISSN: None Source Type: Journal
DOI: 10.1039/a908180a Document Type: Article

Times cited : (37)

References (37)

1
- 0001695399
- 1 A. M. Mebel, C.-C. Hsu, M. C. Lin and K. Morokuma, J. Chem. Phys., 1995, 103, 5640.
- (1995) J. Chem. Phys. , vol.103 , pp. 5640
- Mebel, A.M.¹ Hsu, C.-C.² Lin, M.C.³ Morokuma, K.⁴

2
- 0031559355
- 2 E. W.-G. Diau and S. C. Smith, J. Chem. Phys., 1997, 106, 9236.
- (1997) J. Chem. Phys. , vol.106 , pp. 9236
- Diau, E.W.-G.¹ Smith, S.C.²

3
- 0031208799
- 3 N. Marchant, P. Jimeno, J. C. Rayez and D. Liotard, J. Phys. Chem., 1997, 101, 6077.
- (1997) J. Phys. Chem. , vol.101 , pp. 6077
- Marchant, N.¹ Jimeno, P.² Rayez, J.C.³ Liotard, D.⁴

4
- 0000578722
- 4 L. Vereecken, K. Pierloot and J. Peeters, J. Chem. Phys., 1998, 108, 1068.
- (1998) J. Chem. Phys. , vol.108 , pp. 1068
- Vereecken, L.¹ Pierloot, K.² Peeters, J.³

5
- 0003768228
- Blackwell Scientific, Oxford
- 5 R. G. Gilbert and S. C. Smith, Theory of Unimolecular and Recombination Reactions, Blackwell Scientific, Oxford, 1990.
- (1990) Theory of Unimolecular and Recombination Reactions
- Gilbert, R.G.¹ Smith, S.C.²

6
- 0004255534
- John Wiley & Sons, Chichester, 2nd edn.
- 6 K. A. Holbrook, M. J. Pilling and S. H. Robertson, Unimolecular Reactions, John Wiley & Sons, Chichester, 2nd edn., 1996.
- (1996) Unimolecular Reactions
- Holbrook, K.A.¹ Pilling, M.J.² Robertson, S.H.³

7
- 0013678523
- 7 D. W. Setser, B. S. Rabinovitch and J. W. Simons, J. Chem. Phys., 1964, 40, 1751.
- (1964) J. Chem. Phys. , vol.40 , pp. 1751
- Setser, D.W.¹ Rabinovitch, B.S.² Simons, J.W.³

8
- 6844220275
- 8 B. S. Rabinovitch and M. C. Flowers, Chem. Activation Quart. Rev., 1964, 18, 122.
- (1964) Chem. Activation Quart. Rev. , vol.18 , pp. 122
- Rabinovitch, B.S.¹ Flowers, M.C.²

9
- 36549092392
- 9 N. Snider, J. Chem. Phys., 1984, 80, 1885.
- (1984) J. Chem. Phys. , vol.80 , pp. 1885
- Snider, N.¹

10
- 0000588364
- 10 H. W. Schranz and S. Nordholm, Chem. Phys., 1984, 87, 163.
- (1984) Chem. Phys. , vol.87 , pp. 163
- Schranz, H.W.¹ Nordholm, S.²

11
- 0001241949
- 11 N. J. B. Green, P. J. Marchant, M. J. Perona, M. J. Pilling and S. H. Robertson, J. Phys. Chem., 1992, 96, 5896.
- (1992) J. Phys. Chem. , vol.96 , pp. 5896
- Green, N.J.B.¹ Marchant, P.J.² Perona, M.J.³ Pilling, M.J.⁴ Robertson, S.H.⁵

12
- 0001614646
- 12 S. C. Smith, M. J. McEwan and R. G. Gilbert, J. Phys. Chem., 1989, 90, 4265.
- (1989) J. Phys. Chem. , vol.90 , pp. 4265
- Smith, S.C.¹ McEwan, M.J.² Gilbert, R.G.³

13
- 0000660736
- 13 J. Troe, Annu. Rev. Phys. Chem., 1978, 29, 223.
- (1978) Annu. Rev. Phys. Chem. , vol.29 , pp. 223
- Troe, J.¹

14
- 0013684502
- 14 N. Snider, J. Chem. Phys., 1984, 81, 3745.
- (1984) J. Chem. Phys. , vol.81 , pp. 3745
- Snider, N.¹

15
- 0026220488
- 15 M. Olzmann, J. Gebhardt and K. Scherzer, Int. J. Chem. Kinet., 1991, 23, 825.
- (1991) Int. J. Chem. Kinet. , vol.23 , pp. 825
- Olzmann, M.¹ Gebhardt, J.² Scherzer, K.³

16
- 0001460613
- 16 P. K. Venkatesh, A. M. Dean, M. H. Cohen and R. W. Carr, J. Chem. Phys., 1997, 107, 8904.
- (1997) J. Chem. Phys. , vol.107 , pp. 8904
- Venkatesh, P.K.¹ Dean, A.M.² Cohen, M.H.³ Carr, R.W.⁴

17
- 0001270082
- 17 L. Vereecken, G. Huyberechts and J. Peeters, J. Chem. Phys., 1997, 106, 6564.
- (1997) J. Chem. Phys. , vol.106 , pp. 6564
- Vereecken, L.¹ Huyberechts, G.² Peeters, J.³

18
- 0001645085
- 18 D. T. Gillespie, J. Comput. Phys., 1978, 28, 395.
- (1978) J. Comput. Phys. , vol.28 , pp. 395
- Gillespie, D.T.¹

19
- 0000458975
- 19 J. R. Barker, Chem. Phys., 1983, 77, 301.
- (1983) Chem. Phys. , vol.77 , pp. 301
- Barker, J.R.¹

20
- 0025385544
- 20 J. Shi and J. R. Barker, Int. J. Chem. Kinet., 1990, 22, 187.
- (1990) Int. J. Chem. Kinet. , vol.22 , pp. 187
- Shi, J.¹ Barker, J.R.²

21
- 0004051885
- World Scientific, Singapore
- 21 J. Z. H. Zhang, Theory and applications of Quantum Molecular Dynamics, World Scientific, Singapore, 1999.
- (1999) Theory and Applications of Quantum Molecular Dynamics
- Zhang, J.Z.H.¹

22
- 0004236492
- Johns Hopkins University Press, Baltimore, 3rd edn.
- 22 G. H. Golub and C. F. van Loan, Matrix Computations, Johns Hopkins University Press, Baltimore, 3rd edn., 1996.
- (1996) Matrix Computations
- Golub, G.H.¹ Van Loan, C.F.²

23
- 0001747540
- 23 M. A. Hanning-Lee, N. J. B. Green, M. J. Pilling and S. H. Robertson, J. Phys. Chem., 1993, 97, 860.
- (1993) J. Phys. Chem. , vol.97 , pp. 860
- Hanning-Lee, M.A.¹ Green, N.J.B.² Pilling, M.J.³ Robertson, S.H.⁴

24
- 0000889511
- 24 N. J. B. Green, S. H. Robertson and M. J. Pilling, J. Chem. Phys., 1994, 100, 5259.
- (1994) J. Chem. Phys. , vol.100 , pp. 5259
- Green, N.J.B.¹ Robertson, S.H.² Pilling, M.J.³

25
- 33751386513
- 25 P. W. Seakins, S. H. Robertson, M. J. Pilling, I. R. Slagle, G. W. Gmurczyk, A. Bencsura, D. Gutman and W. Tsang, J. Phys. Chem., 1993, 97, 4450.
- (1993) J. Phys. Chem. , vol.97 , pp. 4450
- Seakins, P.W.¹ Robertson, S.H.² Pilling, M.J.³ Slagle, I.R.⁴ Gmurczyk, G.W.⁵ Bencsura, A.⁶ Gutman, D.⁷ Tsang, W.⁸

26
- 0031558344
- 26 K. E. Gates, S. H. Robertson, S. C. Smith, M. J. Pilling, M. S. Beasley and K. J. Maschhoff, J. Phys. Chem. A, 1997, 101, 5765.
- (1997) J. Phys. Chem. A , vol.101 , pp. 5765
- Gates, K.E.¹ Robertson, S.H.² Smith, S.C.³ Pilling, M.J.⁴ Beasley, M.S.⁵ Maschhoff, K.J.⁶

27
- 0034652447
- 27 M. Blitz, M. S. Beasley, M. J. Pilling and S. H. Robertson, Phys. Chem. Chem. Phys., 2000, 2, 805.
- (2000) Phys. Chem. Chem. Phys. , vol.2 , pp. 805
- Blitz, M.¹ Beasley, M.S.² Pilling, M.J.³ Robertson, S.H.⁴

28
- 34547689720
- 28 S. H. Robertson, A. I. Shushin and D. M. Wardlaw, J. Chem. Phys., 1993, 98, 8673.
- (1993) J. Chem. Phys. , vol.98 , pp. 8673
- Robertson, S.H.¹ Shushin, A.I.² Wardlaw, D.M.³

29
- 0000613447
- 29 S. H. Robertson, M. J. Pilling, K. E. Gates and S. C. Smith, J. Comput. Chem., 1997, 18, 1004.
- (1997) J. Comput. Chem. , vol.18 , pp. 1004
- Robertson, S.H.¹ Pilling, M.J.² Gates, K.E.³ Smith, S.C.⁴

30
- 0003706460
- SIAM, Philadelphia, 2nd edn.
- 30 E. Andersen, Z. Bai, C. Bischof, J. Demmel and J. Dongarra, Lapack Users Guide, SIAM, Philadelphia, 2nd edn., 1995.
- (1995) Lapack Users Guide
- Andersen, E.¹ Bai, Z.² Bischof, C.³ Demmel, J.⁴ Dongarra, J.⁵

31
- 0003851780
- 31 R. B. Lehoucq, D. C. Sorensen and C. Yang, ARPACK Users' Guide: Solution of Large Scale Eigenvalue Problems with Implicitly Restarted Arnoldi Methods, available from http:// www.caam.rice.edu/software/ARPACK.
- ARPACK Users' Guide: Solution of Large Scale Eigenvalue Problems with Implicitly Restarted Arnoldi Methods
- Lehoucq, R.B.¹ Sorensen, D.C.² Yang, C.³

32
- 0021371028
- 32 M. Quack, Ber. Bunsen-Ges. Phys. Chem., 1984, 88, 94.
- (1984) Ber. Bunsen-Ges. Phys. Chem. , vol.88 , pp. 94
- Quack, M.¹

33
- 0001011723
- 33 G. W. Harris and N. J. Pitts, Jr, J. Chem. Phys., 1982, 77, 3994.
- (1982) J. Chem. Phys. , vol.77 , pp. 3994
- Harris, G.W.¹ Pitts N.J., Jr.²

34
- 0000338548
- 34 S. H. Robertson, M. J. Pilling, D. A. Baulch and N. J. B. Green, J. Phys. Chem., 1995, 99, 13452.
- (1995) J. Phys. Chem. , vol.99 , pp. 13452
- Robertson, S.H.¹ Pilling, M.J.² Baulch, D.A.³ Green, N.J.B.⁴

35
- 33845280245
- 35 M. Karni, I. Oref, S. Barzilai-Gilboa and A. Lifshitz, J. Phys. Chem., 1988, 92, 6924.
- (1988) J. Phys. Chem. , vol.92 , pp. 6924
- Karni, M.¹ Oref, I.² Barzilai-Gilboa, S.³ Lifshitz, A.⁴

36
- 0000322706
- 36 D. C. Sorenson, SIAM J. Matrix Anal. Appl., 1992, 13, 357.
- (1992) SIAM J. Matrix Anal. Appl. , vol.13 , pp. 357
- Sorenson, D.C.¹

37
- 0013636975
- in press
- 37 T. J. Frankcombe and S. C. Smith, J. Comput. Chem., in press.
- J. Comput. Chem.
- Frankcombe, T.J.¹ Smith, S.C.²

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