Reverse Nonequilibrium Molecular Dynamics Calculation of the Soret Coefficient in Liquid Heptane/Benzene Mixtures

Pavel Polyakov; Florian Müller-Plathe; Simone Wiegand

doi:10.1021/jp805449j

Reverse Nonequilibrium Molecular Dynamics Calculation of the Soret Coefficient in Liquid Heptane/Benzene Mixtures

The Journal of Physical Chemistry B ◽

10.1021/jp805449j ◽

2008 ◽

Vol 112 (47) ◽

pp. 14999-15004 ◽

Cited By ~ 10

Author(s):

Pavel Polyakov ◽

Florian Müller-Plathe ◽

Simone Wiegand

Keyword(s):

Molecular Dynamics ◽

Nonequilibrium Molecular Dynamics ◽

Soret Coefficient ◽

Dynamics Calculation

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Reverse nonequilibrium molecular-dynamics calculation of the Soret coefficient in liquid benzene/cyclohexane mixtures

The Journal of Chemical Physics ◽

10.1063/1.2042427 ◽

2005 ◽

Vol 123 (12) ◽

pp. 124502 ◽

Cited By ~ 24

Author(s):

Meimei Zhang ◽

Florian Müller-Plathe

Keyword(s):

Molecular Dynamics ◽

Nonequilibrium Molecular Dynamics ◽

Soret Coefficient ◽

Liquid Benzene ◽

Dynamics Calculation

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Nonequilibrium molecular dynamics calculation of self‐diffusion in a non‐Newtonian fluid subject to a Couette strain field

The Journal of Chemical Physics ◽

10.1063/1.459886 ◽

1991 ◽

Vol 94 (3) ◽

pp. 2149-2158 ◽

Cited By ~ 54

Author(s):

P. T. Cummings ◽

B. Y. Wang ◽

D. J. Evans ◽

K. J. Fraser

Keyword(s):

Molecular Dynamics ◽

Newtonian Fluid ◽

Strain Field ◽

Nonequilibrium Molecular Dynamics ◽

Self Diffusion ◽

Dynamics Calculation

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Boundary-Driven Non-Equilibrium Molecular Dynamics Calculation of the Soret Coefficient in n-Hexane/n-Dodecane Mixtures

Russian Journal of Physical Chemistry B ◽

10.1134/s1990793121030180 ◽

2021 ◽

Vol 15 (3) ◽

pp. 539-546

Author(s):

Xiaoyu Chen ◽

Ruquan Liang ◽

Yong Wang ◽

Ziqi Xia ◽

Lichun Wu ◽

...

Keyword(s):

Molecular Dynamics ◽

Soret Coefficient ◽

Non Equilibrium Molecular Dynamics ◽

Dynamics Calculation ◽

Non Equilibrium

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Comment on: Nonequilibrium molecular dynamics calculation of self‐diffusion in a non‐Newtonian fluid subject to a Couette strain field

The Journal of Chemical Physics ◽

10.1063/1.461253 ◽

1991 ◽

Vol 95 (11) ◽

pp. 8675-8676 ◽

Cited By ~ 16

Author(s):

Sten Sarman ◽

Denis J. Evans ◽

Peter T. Cummings

Keyword(s):

Molecular Dynamics ◽

Newtonian Fluid ◽

Strain Field ◽

Nonequilibrium Molecular Dynamics ◽

Self Diffusion ◽

Dynamics Calculation

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Nonequilibrium molecular dynamics calculation of the shear viscosity of liquid water

The Journal of Chemical Physics ◽

10.1063/1.455407 ◽

1988 ◽

Vol 89 (10) ◽

pp. 6391-6398 ◽

Cited By ~ 24

Author(s):

P. T. Cummings ◽

T. L. Varner

Keyword(s):

Molecular Dynamics ◽

Shear Viscosity ◽

Liquid Water ◽

Nonequilibrium Molecular Dynamics ◽

Dynamics Calculation

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Reverse Nonequilibrium Molecular Dynamics Calculation of the Resist Shear Viscosity in UV-Nanoimprint Lithography

Journal of Computational and Theoretical Nanoscience ◽

10.1166/jctn.2013.2680 ◽

2013 ◽

Vol 10 (1) ◽

pp. 208-212

Author(s):

Jun Du ◽

Zhengying Wei ◽

Yiping Tang

Keyword(s):

Molecular Dynamics ◽

Shear Viscosity ◽

Nanoimprint Lithography ◽

Nonequilibrium Molecular Dynamics ◽

Dynamics Calculation

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Nonequilibrium molecular dynamics calculation of the thermal conductivity based on an improved relaxation scheme

The Journal of Chemical Physics ◽

10.1063/1.2969762 ◽

2008 ◽

Vol 129 (7) ◽

pp. 074106 ◽

Cited By ~ 16

Author(s):

Bing-Yang Cao

Keyword(s):

Thermal Conductivity ◽

Molecular Dynamics ◽

Nonequilibrium Molecular Dynamics ◽

Relaxation Scheme ◽

Dynamics Calculation

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Nonequilibrium molecular dynamics calculation of the conductance of the KcsA potassium ion channel

Physical Review E ◽

10.1103/physreve.74.030905 ◽

2006 ◽

Vol 74 (3) ◽

Cited By ~ 5

Author(s):

Hendrick W. de Haan ◽

Igor S. Tolokh ◽

C. G. Gray ◽

Saul Goldman

Keyword(s):

Molecular Dynamics ◽

Ion Channel ◽

Potassium Ion ◽

Nonequilibrium Molecular Dynamics ◽

Potassium Ion Channel ◽

Dynamics Calculation

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Computing the Soret coefficient in aqueous mixtures using boundary driven nonequilibrium molecular dynamics

The Journal of Chemical Physics ◽

10.1063/1.1863872 ◽

2005 ◽

Vol 122 (11) ◽

pp. 114503 ◽

Cited By ~ 33

Author(s):

Carlos Nieto-Draghi ◽

Josep Bonet Ávalos ◽

Bernard Rousseau

Keyword(s):

Molecular Dynamics ◽

Nonequilibrium Molecular Dynamics ◽

Soret Coefficient ◽

Aqueous Mixtures

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Nonequilibrium Molecular Dynamics Calculation of the Thermal Conductivity of Solid Materials

The Journal of Physical Chemistry B ◽

10.1021/jp021189z ◽

2003 ◽

Vol 107 (3) ◽

pp. 826-828 ◽

Cited By ~ 12

Author(s):

Henry J. Castejon

Keyword(s):

Thermal Conductivity ◽

Molecular Dynamics ◽

Nonequilibrium Molecular Dynamics ◽

Solid Materials ◽

Dynamics Calculation

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