Editing Predictor-Corrector methods
Jump to navigation
Jump to search
The edit can be undone. Please check the comparison below to verify that this is what you want to do, and then publish the changes below to finish undoing the edit.
| Latest revision | Your text | ||
| Line 3: | Line 3: | ||
#[http://dx.doi.org/10.1002/jcc.10385 Jirí Kolafa "Time-reversible always stable predictor-corrector method for molecular dynamics of polarizable molecules", Journal of Computational Chemistry '''25''' pp. 335-342 (2004)] | #[http://dx.doi.org/10.1002/jcc.10385 Jirí Kolafa "Time-reversible always stable predictor-corrector method for molecular dynamics of polarizable molecules", Journal of Computational Chemistry '''25''' pp. 335-342 (2004)] | ||
#[http://dx.doi.org/10.1063/1.1884107 Jiri Kolafa "Gear formalism of the always stable predictor-corrector method for molecular dynamics of polarizable molecules", Journal of Chemical Physics '''122''' 164105 (2005)] | #[http://dx.doi.org/10.1063/1.1884107 Jiri Kolafa "Gear formalism of the always stable predictor-corrector method for molecular dynamics of polarizable molecules", Journal of Chemical Physics '''122''' 164105 (2005)] | ||
*[ftp://ftp.dl.ac.uk/ccp5/ALLEN_TILDESLEY/F.02 5-value Gear predictor-corrector algorithm] sample FORTRAN computer code from the book [http://www.oup.com/uk/catalogue/?ci=9780198556459 M. P. Allen and D. J. Tildesley "Computer Simulation of Liquids", Oxford University Press (1989)]. | *[ftp://ftp.dl.ac.uk/ccp5/ALLEN_TILDESLEY/F.02 5-value Gear predictor-corrector algorithm] sample FORTRAN computer code from the book [http://www.oup.com/uk/catalogue/?ci=9780198556459 M. P. Allen and D. J. Tildesley "Computer Simulation of Liquids", Oxford University Press (1989)]. | ||
[[category: molecular dynamics]] | [[category: molecular dynamics]] | ||