Molecular dynamics simulation of an aqueous sodium octanoate micelle using polarizable surfactant molecules

John C. Shelley; Michiel Sprik; Michael L. Klein

doi:10.1021/la00028a008

Molecular dynamics simulation of an aqueous sodium octanoate micelle using polarizable surfactant molecules

Langmuir ◽

10.1021/la00028a008 ◽

1993 ◽

Vol 9 (4) ◽

pp. 916-926 ◽

Cited By ~ 68

Author(s):

John C. Shelley ◽

Michiel Sprik ◽

Michael L. Klein

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Sodium Octanoate ◽

Aqueous Sodium

Download Full-text

Molecular dynamics simulation of an aqueous sodium perchlorate solution

The Journal of Physical Chemistry ◽

10.1021/j100286a020 ◽

1987 ◽

Vol 91 (2) ◽

pp. 331-338 ◽

Cited By ~ 43

Author(s):

G. Heinje ◽

W. A. P. Luck ◽

K. Heinzinger

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Sodium Perchlorate ◽

Dynamics Simulation ◽

Aqueous Sodium ◽

Perchlorate Solution

Download Full-text

Molecular Dynamics simulation of the sodium octanoate micelle in aqueous solution: comparison of force field parameters and molecular topology effects on the micellar structure

Brazilian Journal of Physics ◽

10.1590/s0103-97332004000100010 ◽

2004 ◽

Vol 34 (1) ◽

pp. 64-72 ◽

Cited By ~ 13

Author(s):

André Farias de Moura ◽

Luiz Carlos Gomide Freitas

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Molecular Dynamics Simulation ◽

Force Field ◽

Dynamics Simulation ◽

Molecular Topology ◽

Sodium Octanoate ◽

Micellar Structure ◽

Force Field Parameters

Download Full-text

Molecular dynamics simulation study of ionic hydration and ion association in dilute and 1 molal aqueous sodium chloride solutions from ambient to supercritical conditions

Geochimica et Cosmochimica Acta ◽

10.1016/s0016-7037(98)00207-5 ◽

1998 ◽

Vol 62 (18) ◽

pp. 3095-3107 ◽

Cited By ~ 94

Author(s):

T. Driesner ◽

T.M. Seward ◽

I.G. Tironi

Keyword(s):

Molecular Dynamics ◽

Sodium Chloride ◽

Molecular Dynamics Simulation ◽

Simulation Study ◽

Ion Association ◽

Dynamics Simulation ◽

Chloride Solutions ◽

Aqueous Sodium ◽

Sodium Chloride Solutions ◽

Ionic Hydration

Download Full-text

Response to Comments on “Molecular Dynamics Simulation of the Surface Tension of Aqueous Sodium Chloride: from Dilute to Highly Supersaturated Solutions and Molten Salt” by Wang et al.

10.5194/acp-2017-1013-ac1 ◽

2018 ◽

Author(s):

Xiaoxiang Wang

Keyword(s):

Molecular Dynamics ◽

Surface Tension ◽

Sodium Chloride ◽

Molecular Dynamics Simulation ◽

Molten Salt ◽

Dynamics Simulation ◽

Aqueous Sodium ◽

Supersaturated Solutions

Download Full-text

Molecular Dynamics Simulation of Aqueous Sodium Chloride Solution at the NaCl(001) Interface with a Polarizable Water Model

Langmuir ◽

10.1021/la011269e ◽

2002 ◽

Vol 18 (2) ◽

pp. 547-556 ◽

Cited By ~ 25

Author(s):

Enno Oyen ◽

Reinhard Hentschke

Keyword(s):

Molecular Dynamics ◽

Sodium Chloride ◽

Molecular Dynamics Simulation ◽

Chloride Solution ◽

Sodium Chloride Solution ◽

Dynamics Simulation ◽

Water Model ◽

Aqueous Sodium Chloride Solution ◽

Aqueous Sodium

Download Full-text

Molecular dynamics simulation of the sodium octanoate micelle in aqueous solution

Chemical Physics Letters ◽

10.1016/j.cplett.2005.05.039 ◽

2005 ◽

Vol 411 (4-6) ◽

pp. 474-478 ◽

Cited By ~ 17

Author(s):

André Farias de Moura ◽

Luiz Carlos Gomide Freitas

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Sodium Octanoate

Download Full-text

Molecular dynamics simulation of solution structure and dynamics of aqueous sodium chloride solutions from dilute to supersaturated concentration

Fluid Phase Equilibria ◽

10.1016/j.fluid.2004.01.013 ◽

2004 ◽

Vol 219 (1) ◽

pp. 49-54 ◽

Cited By ~ 44

Author(s):

Hirohisa Uchida ◽

Masakuni Matsuoka

Keyword(s):

Molecular Dynamics ◽

Sodium Chloride ◽

Molecular Dynamics Simulation ◽

Solution Structure ◽

Dynamics Simulation ◽

Chloride Solutions ◽

Aqueous Sodium ◽

Sodium Chloride Solutions ◽

Structure And Dynamics

Download Full-text

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

Download Full-text

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

Download Full-text

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

Download Full-text