Soft‐sphere model for the crystal–liquid interface: A molecular dynamics calculation of the surface stress

J. Neil Cape; Leslie V. Woodcock

doi:10.1063/1.440392

Soft‐sphere model for the crystal–liquid interface: A molecular dynamics calculation of the surface stress

The Journal of Chemical Physics ◽

10.1063/1.440392 ◽

1980 ◽

Vol 73 (5) ◽

pp. 2420-2429 ◽

Cited By ~ 56

Author(s):

J. Neil Cape ◽

Leslie V. Woodcock

Keyword(s):

Molecular Dynamics ◽

Surface Stress ◽

Liquid Interface ◽

Sphere Model ◽

Soft Sphere ◽

Dynamics Calculation

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Molecular dynamics calculation of phase coexistence properties: The soft-sphere melting transition

Chemical Physics Letters ◽

10.1016/0009-2614(78)89094-0 ◽

1978 ◽

Vol 59 (2) ◽

pp. 271-274 ◽

Cited By ~ 36

Author(s):

J.Neil Cape ◽

Leslie V. Woodcock

Keyword(s):

Molecular Dynamics ◽

Phase Coexistence ◽

Melting Transition ◽

Soft Sphere ◽

Dynamics Calculation

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Molecular-dynamics study of the glass transition in a binary soft-sphere model

Physical Review A ◽

10.1103/physreva.44.8278 ◽

1991 ◽

Vol 44 (12) ◽

pp. 8278-8288 ◽

Cited By ~ 31

Author(s):

H. Miyagawa ◽

Y. Hiwatari

Keyword(s):

Molecular Dynamics ◽

Glass Transition ◽

Sphere Model ◽

Soft Sphere

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Gas-liquid interface influencing electronic structure of phenol based on molecular dynamics simulations and theoretical X-ray absorption spectroscopy

Journal of Molecular Liquids ◽

10.1016/j.molliq.2021.117378 ◽

2021 ◽

Vol 341 ◽

pp. 117378

Author(s):

Shaofeng Xu ◽

Petr Lukes

Keyword(s):

Molecular Dynamics ◽

Electronic Structure ◽

Molecular Dynamics Simulations ◽

Absorption Spectroscopy ◽

Liquid Interface ◽

X Ray ◽

Dynamics Simulations ◽

X Ray Absorption

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Molecular Dynamics Calculation of Interaction Forces between Colloids in Aqueous Electrolyte Solutions Using an Implicit Solvent Model

KAGAKU KOGAKU RONBUNSHU ◽

10.1252/kakoronbunshu.31.295 ◽

2005 ◽

Vol 31 (5) ◽

pp. 295-300 ◽

Cited By ~ 1

Author(s):

Shintaro Morisada ◽

Kenji Muranishi ◽

Hiroyuki Shinto ◽

Ko Higashitani

Keyword(s):

Molecular Dynamics ◽

Aqueous Electrolyte ◽

Electrolyte Solutions ◽

Implicit Solvent ◽

Interaction Forces ◽

Implicit Solvent Model ◽

Aqueous Electrolyte Solutions ◽

Solvent Model ◽

Dynamics Calculation

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Note: Sound velocity of a soft sphere model near the fluid-solid phase transition

The Journal of Chemical Physics ◽

10.1063/1.4944824 ◽

2016 ◽

Vol 144 (12) ◽

pp. 126101 ◽

Cited By ~ 11

Author(s):

Sergey A. Khrapak

Keyword(s):

Phase Transition ◽

Sound Velocity ◽

Solid Phase ◽

Sphere Model ◽

Soft Sphere ◽

Solid Phase Transition

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Molecular dynamics calculation of infra-red spectra of ultra-dispersed atmospheric moisture

Journal of Computational Methods in Sciences and Engineering ◽

10.3233/jcm-2010-0326 ◽

2010 ◽

Vol 10 (3-6) ◽

pp. 321-340

Author(s):

A.Y. Galashev

Keyword(s):

Molecular Dynamics ◽

Atmospheric Moisture ◽

Infra Red ◽

Dynamics Calculation

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Distribution of Hydrophobic Ions and Their Counterions at an Aqueous Liquid−Liquid Interface: A Molecular Dynamics Investigation

The Journal of Physical Chemistry B ◽

10.1021/jp036896m ◽

2004 ◽

Vol 108 (7) ◽

pp. 2285-2294 ◽

Cited By ~ 35

Author(s):

Benoît Schnell ◽

Rachel Schurhammer ◽

Georges Wipff

Keyword(s):

Molecular Dynamics ◽

Liquid Interface ◽

Hydrophobic Ions

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Depth Profiling of Water Molecules at the Liquid−Liquid Interface Using a Combined Surface Vibrational Spectroscopy and Molecular Dynamics Approach

Journal of the American Chemical Society ◽

10.1021/ja071740b ◽

2007 ◽

Vol 129 (30) ◽

pp. 9446-9451 ◽

Cited By ~ 43

Author(s):

Dave S. Walker ◽

Geraldine L. Richmond

Keyword(s):

Molecular Dynamics ◽

Vibrational Spectroscopy ◽

Depth Profiling ◽

Liquid Interface ◽

Water Molecules

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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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Molecular dynamics calculation of the transport coefficients of liquid benzene+cyclohexane mixtures using six‐center Lennard‐Jones potentials

The Journal of Chemical Physics ◽

10.1063/1.466207 ◽

1993 ◽

Vol 99 (12) ◽

pp. 9912-9916 ◽

Cited By ~ 13

Author(s):

H. M. Schaink ◽

H. Luo ◽

C. Hoheisel

Keyword(s):

Molecular Dynamics ◽

Transport Coefficients ◽

Lennard Jones ◽

Liquid Benzene ◽

Dynamics Calculation

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