709 citations · 7.6k across the 159 of their papers we have counts for
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Flat Histogram Method of Wang-Landau and N-fold Way
B. J. Schulz, K. Binder, M. Mueller
We present a method for estimating the density of states of a classical statistical model. The algorithm successfully combines the Wang-Landau flat histogram method with the N-fold…
The dynamics of sodium in sodium disilicate: Channel relaxation and sodium diffusion
Juergen Horbach, Walter Kob, Kurt Binder
We use molecular dynamics computer simulations to study the dynamics of amorphous (Na_2O)2(SiO_2). We find that the Na ions move in channels embedded in a SiO_2 matrix. The charact…
Dynamical Heterogeneities Below the Glass Transition
Katharina Vollmayr-Lee, Walter Kob, Kurt Binder +1
We present molecular dynamics simulations of a binary Lennard-Jones mixture at temperatures below the kinetic glass transition. The ``mobility'' of a particle is characterized by t…
Recent MD Results on Supercooled Thin Polymer Films
Fathollah Varnik, Joerg Baschnagel, Kurt Binder
The dynamic and static properties of a supercooled (non-entangled) polymer melt are investigated via molecular dynamics (MD) simulations. The system is confined between two complet…
Classical and ab initio molecular dynamic simulation of an amorphous silica surface
Claus Mischler, Walter Kob, Kurt Binder
We present the results of a classical molecular dynamic simulation as well as of an ab initio molecular dynamic simulation of an amorphous silica surface. In the case of the classi…
Spinodal Decomposition in a Binary Polymer Mixture: Dynamic Self Consistent Field Theory and Monte Carlo Simulations
E. Reister, M. Mueller, K. Binder
We investigate how the dynamics of a single chain influences the kinetics of early stage phase separation in a symmetric binary polymer mixture. We consider quenches from the disor…