[lammps-users] simulating water

please always keep the mailing list in cc when
replying to responses to the list. thanks.

yes....how do we define the coordinates, initial velocities when we
have two types of atoms...

you can just generate a data file. you can generate it from scratch
or use one of the tools in the - tadaaa - tools directory of the
LAMMPS distribution. that is what i do using

cheers,
   axel.

Dear Prof

Thank you…

Jeetu