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1

A stochastic theory of chemical reaction rates. II. Applications

Bernard Gaveau, James T. Hynes, Raymond Kapral, Michel Moreau

Journal:

Journal of Statistical Physics

Year:

1989

Language:

english

File:

PDF, 616 KB

english, 1989

2

A stochastic theory of chemical reaction rates. I. Formalism

Bernard Gaveau, James T. Hynes, Raymond Kapral, Michel Moreau

Journal:

Journal of Statistical Physics

Year:

1989

Language:

english

File:

PDF, 649 KB

english, 1989

3

Synchronization and chaos in coupled nonlinear oscillators

Irene Waller, Raymond Kapral

Journal:

Physics Letters A

Year:

1984

Language:

english

File:

PDF, 359 KB

english, 1984

4

Chemical Waves and Patterns || Turing Patterns: From Myth to Reality

Kapral, Raymond, Showalter, Kenneth

Year:

1995

Language:

english

File:

PDF, 6.85 MB

english, 1995

5

Quantum effects on the solvent contribution to the activation free energy

Mauro Ferrario, Daniel Laria, Giovanni Ciccotti, Raymond Kapral

Journal:

Journal of Molecular Liquids

Year:

1994

Language:

english

File:

PDF, 433 KB

english, 1994

6

Lattice gas automata for reactive systems

Jean Pierre Boon, David Dab, Raymond Kapral, Anna Lawniczak

Journal:

Physics Reports

Year:

1996

Language:

english

File:

PDF, 7.63 MB

english, 1996

7

Constrained reaction coordinate dynamics for the simulation of rare events

E.A. Carter, Giovanni Ciccotti, James T. Hynes, Raymond Kapral

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 474 KB

english, 1989

8

Catalytic Nanomotors: Self-Propelled Sphere Dimers

Leonardo F. Valadares, Yu-Guo Tao, Nicole S. Zacharia, Vladimir Kitaev, Fernando Galembeck, Raymond Kapral, Geoffrey A. Ozin

Journal:

Year:

2010

Language:

english

File:

PDF, 671 KB

english, 2010

9

Discrete models for chemically reacting systems

Journal:

Journal of Mathematical Chemistry

Year:

1991

Language:

english

File:

PDF, 4.32 MB

english, 1991

10

Microscopic theory of brownian motion: II. Nonlinear Langevin equations

James T. Hynes, Raymond Kapral, Michael Weinberg

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1975

Language:

english

File:

PDF, 886 KB

english, 1975

11

Solute molecular dynamics in a mesoscale solvent

Malevanets, Anatoly, Kapral, Raymond

Journal:

The Journal of Chemical Physics

Year:

2000

Language:

english

File:

PDF, 522 KB

english, 2000

12

Coarse-grain simulations of active molecular machines in lipid bilayers

Huang, Mu-Jie, Kapral, Raymond, Mikhailov, Alexander S., Chen, Hsuan-Yi

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 2.57 MB

english, 2013

13

Spatial and temporal structure in systems of coupled nonlinear oscillators

Waller, Irene, Kapral, Raymond

Journal:

Physical Review A

Year:

1984

Language:

english

File:

PDF, 560 KB

english, 1984

14

THERMODYNAMICS EXTENDED

KAPRAL, RAYMOND

Journal:

Chemical & Engineering News

Year:

2008

Language:

english

File:

PDF, 342 KB

english, 2008

15

Coloring a Lorentz gas

Nielsen, Steve, Kapral, Raymond

Journal:

The Journal of Chemical Physics

Year:

1998

Language:

english

File:

PDF, 485 KB

english, 1998

16

Direct simulation of dichotomous noise-induced transitions in a bistable system

L’Heureux, Ivan, Kapral, Raymond

Journal:

The Journal of Chemical Physics

Year:

1989

Language:

english

File:

PDF, 691 KB

english, 1989

17

Coupled maps and pattern formation on the Sierpinski gasket

Cosenza, Mario G., Kapral, Raymond

Journal:

Chaos An Interdisciplinary Journal of Nonlinear Science

Year:

1992

Language:

english

File:

PDF, 610 KB

english, 1992

18

Vortex dynamics in oscillatory chemical systems

Wu, Xiao-Guang, Chee, Merk-Na, Kapral, Raymond

Journal:

Chaos An Interdisciplinary Journal of Nonlinear Science

Year:

1991

Language:

english

File:

PDF, 996 KB

english, 1991

19

Forward–backward solution of quantum-classical Liouville equation in the adiabatic mapping basis

Hsieh, Chang-Yu, Schofield, Jeremy, Kapral, Raymond

Journal:

Molecular Physics

Year:

2013

Language:

english

File:

PDF, 217 KB

english, 2013

20

Self-propulsion through symmetry breaking

de Buyl, Pierre, Mikhailov, Alexander S., Kapral, Raymond

Journal:

EPL (Europhysics Letters)

Year:

2013

Language:

english

File:

PDF, 6.40 MB

english, 2013

21

[WORLD SCIENTIFIC Proceedings of the International School of Physics - LERICI, Villa Marigola (7 – 18 July 1997)] Classical and Quantum Dynamics in Condensed Phase Simulations - Nonadiabatic molecular dynamics methods for diffusion

LARIA, DANIEL, CICCOTTI, GIOVANNI, COKER, DAVID F., KAPRAL, RAYMOND, FERRARIO, MAURO

Language:

english

File:

PDF, 1.55 MB

english

22

[WORLD SCIENTIFIC Proceedings of the International School of Physics - LERICI, Villa Marigola (7 – 18 July 1997)] Classical and Quantum Dynamics in Condensed Phase Simulations - Chemical rate laws and rate constants

KAPRAL, RAYMOND, CONSTA, STYLIANI, MCWHIRTER, LIAM

Language:

english

File:

PDF, 2.05 MB

english

23

Nonequilibrium thermodynamics and boundary conditions for reaction and transport in heterogeneous media

Gaspard, Pierre, Kapral, Raymond

Journal:

The Journal of Chemical Physics

Year:

2018

Language:

english

File:

PDF, 555 KB

english, 2018

24

Synthetic Nanomotors: Working Together through Chemistry

Robertson, Bryan, Huang, Mu-Jie, Chen, Jiang-Xing, Kapral, Raymond

Journal:

Accounts of Chemical Research

Year:

2018

Language:

english

File:

PDF, 8.34 MB

english, 2018

25

Interaction of a Chemically Propelled Nanomotor with a Chemical Wave

Snigdha Thakur, Jiang-Xing Chen, Prof. Raymond Kapral

Journal:

Angewandte Chemie

Year:

2011

Language:

english

File:

PDF, 1.81 MB

english, 2011

26

Interaction of a Chemically Propelled Nanomotor with a Chemical Wave

Snigdha Thakur, Jiang-Xing Chen, Prof. Raymond Kapral

Journal:

Angewandte Chemie International Edition

Year:

2011

Language:

english

File:

PDF, 1.78 MB

english, 2011

27

Blue Moon Sampling, Vectorial Reaction Coordinates, and Unbiased Constrained Dynamics

Giovanni Ciccotti, Raymond Kapral, Eric Vanden-Eijnden

Journal:

Year:

2005

Language:

english

File:

PDF, 95 KB

english, 2005

28

Proton and Deuteron Transfer Reactions in Molecular Nanoclusters

Hyojoon Kim, Raymond Kapral

Journal:

Year:

2008

Language:

english

File:

PDF, 354 KB

english, 2008

29

Self-Propelled Polymer Nanomotors

Yu-Guo Tao, Raymond Kapral

Journal:

Year:

2009

Language:

english

File:

PDF, 362 KB

english, 2009

30

Polymerase Chain Reaction: A Markov Process Approach

MIKHAIL V VELIKANOV, RAYMOND KAPRAL

Journal:

Journal of Theoretical Biology

Year:

1999

Language:

english

File:

PDF, 191 KB

english, 1999

31

Rotational relaxation in the Ar—N2 system

Alan Gelb, Raymond Kapral

Journal:

Chemical Physics Letters

Year:

1972

Language:

english

File:

PDF, 314 KB

english, 1972

32

Potential energy surface for the hydrogen molecule-helium system

C.Woodrow Wilson Jr., Raymond Kapral, George Burns

Journal:

Chemical Physics Letters

Year:

1974

Language:

english

File:

PDF, 392 KB

english, 1974

33

Dynamical correlations in rough sphere fluids

J.R. Mehaffey, Rashmi C. Desai, Raymond Kapral

Journal:

Chemical Physics Letters

Year:

1977

Language:

english

File:

PDF, 369 KB

english, 1977

34

Slip boundary condition for rough sphere rotation

James T. Hynes, Raymond Kapral, Michael Weinberg

Journal:

Chemical Physics Letters

Year:

1977

Language:

english

File:

PDF, 365 KB

english, 1977

35

Slip boundary condition and rough sphere angular velocity correlations

James T. Hynes, Raymond Kapral, Michael Weinberg

Journal:

Chemical Physics Letters

Year:

1977

Language:

english

File:

PDF, 287 KB

english, 1977

36

Activation energies by molecular dynamics with constraints

Emanuele Paci, Giovanni Ciccotti, Mauro Ferrario, Raymond Kapral

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 523 KB

english, 1991

37

Subharmonic and chaotic bifurcation structure in optical bistability

Paul Mandel, Raymond Kapral

Journal:

Optics Communications

Year:

1983

Language:

english

File:

PDF, 386 KB

english, 1983

38

Competition between stable states in spatially-distributed systems

Raymond Kapral, Gian-Luca Oppo

Journal:

Physica D: Nonlinear Phenomena

Year:

1986

Language:

english

File:

PDF, 831 KB

english, 1986

39

Reactive lattice gas automata

Anna Lawniczak, David Dab, Raymond Kapral, Jean-Pierre Boon

Journal:

Physica D: Nonlinear Phenomena

Year:

1991

Language:

english

File:

PDF, 1.76 MB

english, 1991

40

Collision dynamics of fronts in the Korteweg-de Vries-Burgers equation

Sanjay Puri, Rashmi C. Desai, Raymond Kapral

Journal:

Physica D: Nonlinear Phenomena

Year:

1995

Language:

english

File:

PDF, 819 KB

english, 1995

41

Translational hydrodynamics for binary mixtures: Memory from internal molecular relaxation

Raymond Kapral, Rashmi C. Desai

Journal:

Chemical Physics

Year:

1974

Language:

english

File:

PDF, 1.38 MB

english, 1974

42

Constrained molecular dynamics and the mean potential for an ion pair in a polar solvent

Giovanni Ciccotti, Mauro Ferrario, James T. Hynes, Raymond Kapral

Journal:

Chemical Physics

Year:

1989

Language:

english

File:

PDF, 897 KB

english, 1989

43

Activation free energy for proton transfer in solution

Daniel Laria, Giovanni Ciccotti, Mauro Ferrario, Raymond Kapral

Journal:

Chemical Physics

Year:

1994

Language:

english

File:

PDF, 849 KB

english, 1994

44

A one-dimensional-map model for noise-induced transitions between bistable states

Edward A. Celarier, Simon Fraser, Raymond Kapral

Journal:

Physics Letters A

Year:

1983

Language:

english

File:

PDF, 242 KB

english, 1983

45

White noise induced transitions between a limit cycle and a fixed point

Ivan L'Heureux, Raymond Kapral

Journal:

Physics Letters A

Year:

1989

Language:

english

File:

PDF, 416 KB

english, 1989

46

Microscopic theory of brownian motion: III. The nonlinear Fokker-Planck equation

James T. Hynes, Raymond Kapral, Michael Weinberg

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1975

Language:

english

File:

PDF, 414 KB

english, 1975

47

Particle rotation and translation in a fluid with spin

James T. Hynes, Raymond Kapral, Michael Weinberg

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1977

Language:

english

File:

PDF, 935 KB

english, 1977

48

Phase separation and growth in a two-variable discrete model

Raymond Kapral, Gian-Luca Oppo, D.Bartholomew Brown

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1987

File:

PDF, 786 KB

1987

49

Catalytic CO oxidation on Pt surfaces: a lattice-gas cellular automaton model

Xiao-Guang Wu, Raymond Kapral

Journal:

Physica A: Statistical Mechanics and its Applications

Year:

1992

Language:

english

File:

PDF, 1019 KB

english, 1992

50

Reactive multiparticle collision dynamics

Katrin Rohlf, Simon Fraser, Raymond Kapral

Journal:

Computer Physics Communications

Year:

2008

Language:

english

File:

PDF, 602 KB

english, 2008