Reversible reference system propagation algorithm: Difference between revisions

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{{Short description|Time-stepping algorithm in molecular dynamics}}
{{Orphan|date=December 2010}}
{{one source |date=March 2024}}
 
'''Reversible reference system propagation algorithm''', or ('''r-RESPA''') is a [[time stepping]] [[algorithm]] used in [[molecular dynamics]].<ref>AR Leach. ''Molecular modelling: principles and applications'' 1998, p. 363</ref>
 
It evolves the system state over time,
 
:<math>\Gamma(t) = e^{iLt}\Gamma(t=0) \, </math>
 
where the ''L'' is the [[Liouville operator]].
 
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<references/>
 
[[Category:Molecular dynamics]]
{{Uncategorized stub|date=September 2010}}
[[Category:Hamiltonian mechanics]]