Finite-size effects in molecular dynamics simulations: Static structure factor and compressibility. I. Theoretical method

Physical Review E ◽

10.1103/physreve.53.2382 ◽

1996 ◽

Vol 53 (3) ◽

pp. 2382-2389 ◽

Author(s):

J. J. Salacuse ◽

A. R. Denton ◽

P. A. Egelstaff

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Structure Factor ◽

Size Effects ◽

Finite Size ◽

Theoretical Method ◽

Static Structure Factor ◽

Static Structure ◽

Finite Size Effects ◽

Dynamics Simulations

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Finite-size effects in molecular dynamics simulations: Static structure factor and compressibility. II. Application to a model krypton fluid

Physical Review E ◽

10.1103/physreve.53.2390 ◽

1996 ◽

Vol 53 (3) ◽

pp. 2390-2401 ◽

Author(s):

J. J. Salacuse ◽

A. R. Denton ◽

P. A. Egelstaff ◽

M. Tau ◽

L. Reatto

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Structure Factor ◽

Size Effects ◽

Finite Size ◽

Static Structure Factor ◽

Static Structure ◽

Finite Size Effects ◽

Dynamics Simulations

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Finite size effects in the static structure factor of dusty plasmas

Physics of Plasmas ◽

10.1063/1.4887009 ◽

2014 ◽

Vol 21 (7) ◽

pp. 073704 ◽

Author(s):

A. E. Davletov ◽

L. T. Yerimbetova ◽

Ye. S. Mukhametkarimov ◽

A. K. Ospanova

Keyword(s):

Structure Factor ◽

Size Effects ◽

Finite Size ◽

Dusty Plasmas ◽

Static Structure Factor ◽

Static Structure ◽

Finite Size Effects

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Molecular dynamics simulations of the liquid–vapor interface of a molten salt. II. Finite size effects and comparison to experiment

The Journal of Chemical Physics ◽

10.1063/1.1410394 ◽

2001 ◽

Vol 115 (18) ◽

pp. 8612-8619 ◽

Author(s):

Andrés Aguado ◽

W. Scott ◽

Paul A. Madden

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Molten Salt ◽

Size Effects ◽

Finite Size ◽

Finite Size Effects ◽

Vapor Interface ◽

Dynamics Simulations ◽

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Finite-size effects on the static structure factor of two-dimensional crystals

Physical Review B ◽

10.1103/physrevb.25.2450 ◽

1982 ◽

Vol 25 (4) ◽

pp. 2450-2462 ◽

Author(s):

F. Weling ◽

A. Griffin

Keyword(s):

Structure Factor ◽

Size Effects ◽

Finite Size ◽

Static Structure Factor ◽

Two Dimensional ◽

Static Structure ◽

Finite Size Effects

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Molecular Dynamics Simulations of Asymmetric NaCl and KCl Solutions Separated by Phosphatidylcholine Bilayers: Potential Drops and Structural Changes Induced by Strong Na+-Lipid Interactions and Finite Size Effects

Biophysical Journal ◽

10.1529/biophysj.107.116335 ◽

2008 ◽

Vol 94 (9) ◽

pp. 3565-3576 ◽

Author(s):

Sun-Joo Lee ◽

Yuhua Song ◽

Nathan A. Baker

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Size Effects ◽

Structural Changes ◽

Finite Size ◽

Finite Size Effects ◽

Lipid Interactions ◽

Dynamics Simulations

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System size and trajectory length dependence of the static structure factor and the diffusion coefficient as calculated from molecular dynamics simulations: The case of SPC/E water

Journal of Molecular Liquids ◽

10.1016/j.molliq.2011.04.004 ◽

2011 ◽

Vol 161 (1) ◽

pp. 36-40 ◽

Author(s):

Orsolya Gereben ◽

László Pusztai

Keyword(s):

Molecular Dynamics ◽

Diffusion Coefficient ◽

Molecular Dynamics Simulations ◽

Structure Factor ◽

System Size ◽

Static Structure Factor ◽

Static Structure ◽

Length Dependence ◽

Trajectory Length ◽

Dynamics Simulations

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Finite-size effects in molecular dynamics simulations: Intermediate scattering function and velocity of sound. III. Theory and application to a model krypton fluid

Physical Review E ◽

10.1103/physreve.64.051201 ◽

2001 ◽

Vol 64 (5) ◽

Author(s):

J. J. Salacuse ◽

P. A. Egelstaff

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Size Effects ◽

Finite Size ◽

Velocity Of Sound ◽

Scattering Function ◽

Finite Size Effects ◽

Intermediate Scattering Function ◽

Dynamics Simulations

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First sharp diffraction peak and intermediate-range order in amorphous silica: finite-size effects in molecular dynamics simulations

Journal of Non-Crystalline Solids ◽

10.1016/0022-3093(94)90351-4 ◽

1994 ◽

Vol 171 (2) ◽

pp. 157-163 ◽

Author(s):

Aiichiro Nakano ◽

Rajiv K. Kalia ◽

Priya Vashishta

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Amorphous Silica ◽

Size Effects ◽

Finite Size ◽

Diffraction Peak ◽

Finite Size Effects ◽

Intermediate Range ◽

Intermediate Range Order ◽

Dynamics Simulations

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Finite-size effects on the lattice dynamics in spin crossover nanomaterials. II. Molecular dynamics simulations

Physical Review B ◽

10.1103/physrevb.96.035427 ◽

2017 ◽

Vol 96 (3) ◽

Author(s):

Mirko Mikolasek ◽

William Nicolazzi ◽

Férial Terki ◽

Gábor Molnár ◽

Azzedine Bousseksou

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Size Effects ◽

Lattice Dynamics ◽

Spin Crossover ◽

Finite Size ◽

Finite Size Effects ◽

Dynamics Simulations

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Structural properties of a calcium aluminosilicate glass from molecular-dynamics simulations: A finite size effects study

The Journal of Chemical Physics ◽

10.1063/1.1724815 ◽

2004 ◽

Vol 120 (21) ◽

pp. 10172-10181 ◽

Author(s):

Patrick Ganster ◽

Magali Benoit ◽

Walter Kob ◽

Jean-Marc Delaye

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Structural Properties ◽

Size Effects ◽

Finite Size ◽

Aluminosilicate Glass ◽

Finite Size Effects ◽

Calcium Aluminosilicate ◽

Dynamics Simulations

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