TIP4P water pair style

Dear LAMMPS users,

I noticed that in the new release of LAMMPS, the former pair style “lj/cut/coul/long/tip4p” has been renamed as “lj/cut/tip4p/long”. I wonder whether there is any essential change of the pair style in addition to the change of the name. Thanks.


Kira Banks

There were some changes, notably how the dummy charge site is computed, resulting in significant speedups. There were also a few small bug fixes.