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'''Reversible reference system propagation algorithm (r-RESPA)''' is a [[time stepping]] [[algorithm]] used in [[molecular dynamics]].<ref>AR Leach. ''Molecular modelling: principles and applications'' 1998, p. 363</ref>
'''Reversible reference system propagation algorithm (r-RESPA)''' is a [[time stepping]] [[algorithm]] used in [[molecular dynamics]].<ref>AR Leach. ''Molecular modelling: principles and applications'' 1998, p. 363</ref>


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==References==
==References==
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[[Category:Algorithms]]
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[[Category:Molecular dynamics]]
[[Category:Molecular dynamics]]
[[Category:Ordinary differential equations]]
[[Category:Ordinary differential equations]]


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Revision as of 00:39, 3 March 2011

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

It evolves the system state over time,

where the L is the Liouville operator.

References

  1. ^ AR Leach. Molecular modelling: principles and applications 1998, p. 363