K. Fuchizaki et K. Kawasaki, HOPPING PROCESSES FROM DYNAMICAL DENSITY-FUNCTIONAL THEORY FOR A DEEPLY SUPERCOOLED HARD-SPHERE LIQUID, Journal of the Physical Society of Japan, 67(7), 1998, pp. 2158-2161
Through the mapping onto the kinetic lattice gas model the dynamical d
ensity functional equation is solved by the Monte Carlo method in a de
eply supercooled hard-sphere liquid, while focusing on how the system
explores the free-energy landscape during a relaxation process. A vari
ety of metastable states appear as the supercooling proceeds beyond th
e equilibrium crystallization point. Our approach is the first to repr
oduce the hopping transitions among these states as a solution of a me
soscopic kinetic equation.