Second virial coefficient of rod-shaped molecules and molecular dynamics simulations of the isotropic phase
(2015)
Journal Article
Heyes, D. M., Turner, P., English, R. J., Williams, R., & Brańka, A. C. (2015). Second virial coefficient of rod-shaped molecules and molecular dynamics simulations of the isotropic phase. Physical Review E, 91(4), 042134-042144. https://doi.org/10.1103/physreve.91.042134
The second virial coefficient, B 2 is computed of linear rigid rods composed of m equally spaced sites interacting with sites on other rods via the hard-sphere or Weeks-Chandler-Andersen (WCA) pair potentials. The dependence of B 2 on a wide ran... Read More about Second virial coefficient of rod-shaped molecules and molecular dynamics simulations of the isotropic phase.