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(New page: This means the ''reversible reference system propagator algorithm'', a well known multiple time step method. == References == *[http://dx.doi.org/10.1063/1.460004 Mark E. Tuckerman, Bruce...) |
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*[http://dx.doi.org/10.1063/1.472005 Steven J. Stuart, Ruhong Zhou, and B. J. Berne "Molecular dynamics with multiple time scales: The selection of efficient reference system propagators" Stuart, S., Zhou, R., and Berne, B., J. Chem. Phys. '''105''' 1426 (1996)] | *[http://dx.doi.org/10.1063/1.472005 Steven J. Stuart, Ruhong Zhou, and B. J. Berne "Molecular dynamics with multiple time scales: The selection of efficient reference system propagators" Stuart, S., Zhou, R., and Berne, B., J. Chem. Phys. '''105''' 1426 (1996)] | ||
* Procacci, P., and Marchi, M., J. Chem. Phys. '''104''' 3003 (1996) | * Procacci, P., and Marchi, M., J. Chem. Phys. '''104''' 3003 (1996) | ||
[[category:molecular dynamics]] | |||
Revision as of 13:08, 12 December 2007
This means the reversible reference system propagator algorithm, a well known multiple time step method.
References
- Mark E. Tuckerman, Bruce J. Berne, and Angelo Rossi "Molecular dynamics algorithm for multiple time scales: Systems with disparate masses" J. Chem. Phys. 94 1465 (1990)
- M. Tuckerman, B. J. Berne and G. J. Martyna "Reversible multiple time scale molecular dynamics", Journal of Chemical Physics 97 pp. 1990-2001 (1992)
- Steven J. Stuart, Ruhong Zhou, and B. J. Berne "Molecular dynamics with multiple time scales: The selection of efficient reference system propagators" Stuart, S., Zhou, R., and Berne, B., J. Chem. Phys. 105 1426 (1996)
- Procacci, P., and Marchi, M., J. Chem. Phys. 104 3003 (1996)