152 citations · 506 across the 51 of their papers we have counts for
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physics.comp-ph2016★ 152 cited
Data-driven parameterization of the generalized Langevin equation
Huan Lei, Nathan Baker, Xiantao Li
We present a data-driven approach to determine the memory kernel and random noise in generalized Langevin equations. To facilitate practical implementations, we parameterize the ke…
physics.comp-ph2016★ 1 cited
PEXSI-: A Green's function embedding method for Kohn-Sham density functional theory
Xiantao Li, Lin Lin, Jianfeng Lu
In this paper, we propose a new Green's function embedding method called PEXSI- for describing complex systems within the Kohn-Sham density functional theory (KSDFT) framework,…