-------- Original-Nachricht -------- > Datum: Tue, 13 Jul 2010 17:27:46 +0200 > Von: pastore at democritos.it > Paolo, I do not see any reason why PW dynamics should continue to be > based on position Verlet. Shifting to Velocity Verlet should be almost > trivial (CP is a completely different story due to the orthogonality > constraint) and there would be the great benefit of a direct control on > the initial velocities.
As described in my other mail, position Verlet allows a simple implementation of initial velocities. (Including a correction of the currently faulty implementation of zero-velocities.) I will have a look at it and try to come up with an implementation. -- GRATIS f?r alle GMX-Mitglieder: Die maxdome Movie-FLAT! Jetzt freischalten unter http://portal.gmx.net/de/go/maxdome01
