Reversible reference system propagation algorithm

Time-stepping algorithm in molecular dynamics

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Reversible reference system propagation algorithm (r-RESPA) is a time stepping algorithm used in molecular dynamics.^[1]

It evolves the system state over time,

\Gamma (t)=e^{iLt}\Gamma (t=0),円

{\displaystyle \Gamma (t)=e^{iLt}\Gamma (t=0),円}

where the L is the Liouville operator.

References

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