Diffusion‐controlled reactions. I. Molecular dynamics simulation of a noncontinuum model

W. Dong; F. Baros; J. C. Andre

doi:10.1063/1.456754

Diffusion‐controlled reactions. I. Molecular dynamics simulation of a noncontinuum model

The Journal of Chemical Physics ◽

10.1063/1.456754 ◽

1989 ◽

Vol 91 (8) ◽

pp. 4643-4650 ◽

Cited By ~ 41

Author(s):

W. Dong ◽

F. Baros ◽

J. C. Andre

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Diffusion Controlled

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Diffusion-Controlled Recrystallization of Water Sorbed into Poly(meth)acrylates Revealed by Variable-Temperature Mid-Infrared Spectroscopy and Molecular Dynamics Simulation

The Journal of Physical Chemistry B ◽

10.1021/acs.jpcb.7b01824 ◽

2017 ◽

Vol 121 (19) ◽

pp. 5133-5141 ◽

Cited By ~ 7

Author(s):

Nobuhiro Yasoshima ◽

Mizuki Fukuoka ◽

Hiromi Kitano ◽

Shigehiro Kagaya ◽

Tatsuya Ishiyama ◽

...

Keyword(s):

Molecular Dynamics ◽

Infrared Spectroscopy ◽

Molecular Dynamics Simulation ◽

Variable Temperature ◽

Dynamics Simulation ◽

Mid Infrared ◽

Mid Infrared Spectroscopy ◽

Diffusion Controlled

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Test of a Fokker-Planck-Kramers equation treatment for short-time dynamics of diffusion-controlled reactions by molecular dynamics simulation in Lennard-Jones fluids

Journal of Molecular Liquids ◽

10.1016/s0167-7322(01)00130-1 ◽

2001 ◽

Vol 90 (1-3) ◽

pp. 271-278 ◽

Cited By ~ 6

Author(s):

Kazuyasu Ibuki ◽

Masakatsu Ueno

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Time Dynamics ◽

Lennard Jones ◽

Diffusion Controlled ◽

Kramers Equation ◽

Short Time ◽

Fokker Planck

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Molecular Dynamics Simulation Of A Model Of Diffusion-Controlled Reactions

International Journal of Modelling and Simulation ◽

10.1080/02286203.1991.11760134 ◽

1991 ◽

Vol 11 (4) ◽

pp. 119-122

Author(s):

W. Dong ◽

F. Baros ◽

J.C. Andre

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Diffusion Controlled

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Molecular dynamics simulation of partially diffusion-controlled reaction between mono- and diatomic molecules

Journal of Molecular Liquids ◽

10.1016/j.molliq.2008.07.004 ◽

2009 ◽

Vol 147 (1-2) ◽

pp. 30-36 ◽

Cited By ~ 2

Author(s):

Ami Uwabe ◽

Masakatsu Ueno ◽

Kazuyasu Ibuki

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Diatomic Molecules ◽

Dynamics Simulation ◽

Diffusion Controlled ◽

Diffusion Controlled Reaction

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Evidence of diffusion-controlled vitrification in Ni/Zr bilayer at medium temperatures by molecular-dynamics simulation

EPL (Europhysics Letters) ◽

10.1209/epl/i1997-00368-1 ◽

1997 ◽

Vol 39 (4) ◽

pp. 401-406 ◽

Cited By ~ 3

Author(s):

W. S Lai ◽

B. X Liu

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Diffusion Controlled

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Rotational dynamics and velocity segregation in plastic KCIO4: a molecular dynamics simulation

Molecular Physics ◽

10.1080/00268979809482256 ◽

1998 ◽

Vol 93 (5) ◽

pp. 703-711

Author(s):

F. AFFOUARD ◽

PH. DEPONDT

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Rotational Dynamics ◽

Dynamics Simulation

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Molecular dynamics simulation of the dynamics of supercooled silica

Philosophical Magazine B ◽

10.1080/014186398259374 ◽

1998 ◽

Vol 77 (2) ◽

pp. 297-303 ◽

Cited By ~ 24

Author(s):

J. Horbach, W. Kob, K. Binder

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation

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ACPD ligands for glutamic receptors : conformational analysis by NMR spectroscopy and molecular dynamics. Simulation in water of glutamic acid analogues containing a cyclopentane ring

Journal de Chimie Physique ◽

10.1051/jcp/1995921809 ◽

1995 ◽

Vol 92 ◽

pp. 1809-1812

Author(s):

V Larue ◽

J Gharby-Benarous ◽

D Todeschi ◽

F Acher ◽

R Azerad ◽

...

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Nmr Spectroscopy ◽

Conformational Analysis ◽

Glutamic Acid ◽

Dynamics Simulation ◽

Cyclopentane Ring

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Nonequilibrium effects in electron-ion strongly coupled plasmas. Molecular dynamics simulation

Journal de Physique IV (Proceedings) ◽

10.1051/jp4:2000545 ◽

2000 ◽

Vol 10 (PR5) ◽

pp. Pr5-255-Pr5-258 ◽

Cited By ~ 5

Author(s):

G. E. Norman ◽

A. A. Valuev ◽

I. A. Valuev

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Strongly Coupled ◽

Strongly Coupled Plasmas ◽

Nonequilibrium Effects ◽

Coupled Plasmas

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A molecular dynamics simulation for an ODIC phase. - III. Analysis of the correlation functions

Journal de Physique ◽

10.1051/jphys:01987004805082100 ◽

1987 ◽

Vol 48 (5) ◽

pp. 821-835 ◽

Cited By ~ 6

Author(s):

Ph. Buchet ◽

R.M. Pick

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Correlation Functions ◽

Dynamics Simulation ◽

Phase Iii

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