For integration schemes like Nose-Hoover that are not NVE but have some other quantity that is conserved, then "Conserved-En. provides the value of this conserved quantity.
~~~~~~~~~~~~ Michael Shirts Assistant Professor Department of Chemical Engineering University of Virginia [email protected] (434)-243-1821 On Mon, Nov 29, 2010 at 12:34 PM, Jim (Rui) Qiao <[email protected]> wrote: > Dear all: > > When using g_energy to analyze the energies of the MD system, an entry > termed "Conserved-En." is provided. What does this term stands for? > The simulation is in NVT ensemble. > > Thanks, > > RQ > -- > gmx-users mailing list [email protected] > http://lists.gromacs.org/mailman/listinfo/gmx-users > Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/Search before posting! > Please don't post (un)subscribe requests to the list. Use the > www interface or send it to [email protected]. > Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [email protected]. Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
