Molecular dynamics simulation of liquid anisotropy. II. Rise and fall transients on a picosecond time scale

1982 ◽  
Vol 76 (11) ◽  
pp. 5480-5483 ◽  
Author(s):  
M. W. Evans
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Time Scale ◽  
Dynamics Simulation ◽  
Picosecond Time Scale

scholarly journals A Microsecond Time Scale Molecular Dynamics Simulation of B2AR in a Membrane

2009 ◽  
Vol 96 (3) ◽  
pp. 340a ◽  
Author(s):  
Tod D. Romo ◽  
Alan Grossfield ◽  
Michael C. Pitman ◽  
Xavier Deupi ◽  
Arnau Cordomi ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Time Scale ◽  
Dynamics Simulation

Molecular Dynamics Simulation of Homogeneous Nucleation in a Lennard Jones Liquid

2008 ◽  
Author(s):  
Aneet D. Narendra ◽  
Abhijit Mukherjee
Keyword(s):  
Molecular Dynamics ◽  
Distribution Function ◽  
Molecular Dynamics Simulation ◽  
Time Scale ◽  
Homogeneous Nucleation ◽  
Life Time ◽  
Dynamics Simulation ◽  
Lennard Jones ◽  
Different Temperatures ◽  
Laboratory Time

Examination of metastable states of fluids provides important information pertinent to cavitation and homogeneous nucleation. Homogeneous nucleation, in particular, is an important topic of research. Molecular Dynamics simulation is a well-endorsed method to simulate metastabilitites, as they are limited to mesoscopic scales of length and time and this life-time is essentially zero on a laboratory time scale. In the present study, a molecular dynamics code has been used in conjunction with MOLDY to investigate phase change in a Lennard-Jones liquid. The Lennard-Jones atoms were subjected to different temperatures at various number densities and the pressure was recorded for each case. The appearance of a change of phase is characterized by the formation of clusters or formation of voids as described by the radial distribution function.

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