Reversible reference system propagation algorithm: Difference between revisions
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{{Short description|Time-stepping algorithm in molecular dynamics}} |
{{Short description|Time-stepping algorithm in molecular dynamics}} |
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'''Reversible reference system propagation algorithm (r-RESPA |
'''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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It evolves the system state over time, |
It evolves the system state over time, |
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Revision as of 20:42, 25 April 2022
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
- ^ AR Leach. Molecular modelling: principles and applications 1998, p. 363
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