Energy drift in reversible time integration
Robert I McLachlan and Matthew Perlmutter
Submitted to Physics Letters A
Abstract:
Energy drift is commonly observed in reversible integrations of
systems of molecular dynamics. We show that this drift can be
modelled as a diffusion and that the typical energy error
after time $T$ is $\O(\sqrt{T})$.
Submitted by R.McLachlan@massey.ac.nz Wed, 27 Jun 2001
Email of author:
R.McLachlan@massey.ac.nz
URL of author:
http://www.massey.ac.nz/~RMcLachl/
Download:
2000-005