Stationary state distribution and efficiency analysis of the Langevin equation via real or virtual dynamics

We analyze the stationary state distribution and efficiency of the Langevin equation and its variants through real or virtual dynamics, and propose the middle scheme, which enlarges the sampling time step by adjusting the order of the thermostat coupling.

November 2017 · Li, Han, Chai, Cong Wang, Zhang, Chen, Liu*, Shao*