Molecular Dynamics Simulations of Multilayer Polyelectrolyte Films:  Effect of Electrostatic and Short-Range Interactions

Langmuir ◽  
2006 ◽  
Vol 22 (24) ◽  
pp. 9994-10002 ◽  
Author(s):  
Pritesh A. Patel ◽  
Junhwan Jeon ◽  
Patrick T. Mather ◽  
Andrey V. Dobrynin
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Short Range ◽  
Dynamics Simulations

Interfacial and coexistence properties of soft spheres with a short-range attractive Yukawa fluid: Molecular dynamics simulations

2012 ◽  
Vol 136 (15) ◽  
pp. 154702 ◽  
Author(s):  
Minerva González-Melchor ◽  
Gregorio Hernández-Cocoletzi ◽  
Jorge López-Lemus ◽  
Alejandro Ortega-Rodríguez ◽  
Pedro Orea
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Short Range ◽  
Soft Spheres ◽  
Yukawa Fluid ◽  
Dynamics Simulations

scholarly journals A VECTORIZED ALGORITHM FOR MOLECULAR DYNAMICS OF SHORT RANGE INTERACTING PARTICLES

1993 ◽  
Vol 04 (05) ◽  
pp. 1049-1057 ◽  
Author(s):  
VOLKHARD BUCHHOLTZ ◽  
THORSTEN PÖSCHEL
Keyword(s):  
Molecular Dynamics ◽  
Granular Material ◽  
Molecular Dynamics Simulations ◽  
Short Range ◽  
Algorithmic Complexity ◽  
Interacting Particles ◽  
Short Range Interaction ◽  
Range Interaction ◽  
Dynamics Simulations ◽  
Number Of Particles

We report on a lattice based algorithm, completely vectorized for molecular dynamics simulations. Its algorithmic complexity is of the order O(N), where N is the number of particles. The algorithm works very effectively when the particles have short range interaction, but it is applicable to each kind of interaction. The code was tested on a CRAY YMP EL in a simulation of flowing granular material.

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