implement RK integrator on the TFCC approach

bsonghao / hot-molecule

TFCC approach for thermal vibronic problem

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implement RK integrator on the TFCC approach #17

Open bsonghao opened 1 year ago

bsonghao commented 1 year ago

81bb9e973ca5038666d78417dd6ba8283e3ed6a0 implement it

bsonghao commented 1 year ago

Initially the result of the calculation with the two integrators is inconsistent but after increasing the numerical step in the primary integrator, I got consistent results