Journal
JOURNAL OF CHEMICAL PHYSICS
Volume 128, Issue 4, Pages -Publisher
AIP Publishing
DOI: 10.1063/1.2823736
Keywords
-
Ask authors/readers for more resources
In this work we present a computer simulation study of charged hard spherocylinders of aspect ratio L/sigma=5, using NVT and NPT Monte Carlo methods. Coulombic interactions are handled using the Wolf method [D. Wolf, P. Keblinski, S. R. Phillpot, and J. Eggebrecht, J. Chem. Phys. 110, 8254 (1999)]. Thermodynamic and structural properties are in excellent agreement with the results obtained with the standard Ewald summation method. A partial prediction of the corresponding phase diagram is obtained by studying two isotherms of this system. The stability of the liquid crystalline phases is examined and compared with the phase diagrams of neutral hard spherocylinders and dipolar hard spherocylinders.
Authors
I am an author on this paper
Click your name to claim this paper and add it to your profile.
Reviews
Recommended
No Data Available