A New Time-Reversible Integrator for Molecular Dynamics Applications

dc.creatorZhakhovskii, Vasilii
dc.date2004-05-24
dc.date2004-11-06
dc.date.accessioned2026-07-07T05:51:56Z
dc.date.available2026-07-07T05:51:56Z
dc.descriptionMolecular Dynamics method is based on solution of Newtonian differential equations of motion. A new very accurate and efficient time-reversible explicit integrator was derived on the basis of second order Tailor expansion of force. There is good reason to think the new method will be easy-to-use for MD and, possibly, celestial mechanics applications.
dc.description4 pages, 2 figures, Eq.(15) was added, more precise MD tests have been performed
dc.identifierhttps://arxiv.org/abs/physics/0405124
dc.identifierhttp://arxiv.org/abs/physics/0405124
dc.identifier.urihttp://salesiana.dossiersoluciones.com/handle/123456789/86162
dc.subjectComputational Physics
dc.titleA New Time-Reversible Integrator for Molecular Dynamics Applications
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