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Hori-Lab / TIS

TIS model code
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Implement other Langevin #8

Open naotohori opened 4 years ago

naotohori commented 4 years ago

BAOAB http://doi.org/10.1063/1.4802990

naotohori commented 3 years ago

Two other integrators have been implemented:

GJF 6e17bc9d54044bf2d3d976fab519afe1004100b0 Grønbech-Jensen, N. & Farago, O. A simple and effective Verlet-type algorithm for simulating Langevin dynamics. Molecular Physics 111, 983–991 (2013). https://doi.org/10.1080/00268976.2012.760055

GJF-2GJ 383b05dc94c8d322098d433aec712c474ce07a81 Jensen, L. F. G. & Grønbech-Jensen, N. Accurate configurational and kinetic statistics in discrete-time Langevin systems. Mol Phys 117, 1–16 (2019). https://doi.org/10.1080/00268976.2019.1570369