Evaluation of P–V–T differential properties of the Lennard-Jones fluid using radial distribution functions and molecular dynamics

2007 ◽  
Vol 335 (2-3) ◽  
pp. 194-200 ◽  
Author(s):  
Ali Morsali ◽  
S. Ali Beyramabadi ◽  
M. Reza Bozorgmehr
Keyword(s):  
Molecular Dynamics ◽  
Radial Distribution ◽  
Distribution Functions ◽  
Radial Distribution Functions ◽  
Lennard Jones ◽  
Differential Properties

Molecular Dynamics Study of the Structural and Dynamical Properties of Liquid Tetrahydrofuran

1990 ◽  
Vol 45 (11-12) ◽  
pp. 1342-1344 ◽  
Author(s):  
W. Drabowicz
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Radial Distribution ◽  
Distribution Functions ◽  
Dynamics Simulation ◽  
Radial Distribution Functions ◽  
Frequency Spectra ◽  
Autocorrelation Functions ◽  
Dynamical Properties

AbstractA molecular dynamics simulation has been performed to investigate the structural and dynamical properties of liquid tetrahydrofuran. In particular, we have calculated six radial distribution functions, translational and rotational autocorrelation functions and their associated frequency spectra.

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