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physics.comp-ph2019★ 44 cited
Data-driven molecular modeling with the generalized Langevin equation
Francesca Grogan, Huan Lei, Xiantao Li +1
The complexity of molecular dynamics simulations necessitates dimension reduction and coarse-graining techniques to enable tractable computation. The generalized Langevin equation…
physics.comp-ph2019★ 13 cited
Exponential Integrators for Stochastic Schrödinger Equation
Jingze Li, Xiantao Li
We present a class of exponential integrators to compute solutions of the stochastic Schrödinger equation arising from the modeling of open quantum systems. In order to be able to…