Hi, everyone.
I currently work on Dissipative Particle Dynamics, and now I wanna
calculate solubility parameter for some polymers. So I doubt whether
LAMMPS could calculate that parameter.
Thank you all.
edw
Hi, everyone.
I currently work on Dissipative Particle Dynamics, and now I wanna
calculate solubility parameter for some polymers. So I doubt whether
LAMMPS could calculate that parameter.
there is not just a single solubility parameter.
there are multiple definitions. so you have to
decide which one you want. furthermore, this
is a "derived" property, i.e. you may be able
to use lammps to compute the components
that you need for computing this parameter,
but you may have then to do the final combination
by yourself. that being said, this will, of course,
only provide the parameter with respect to the
force field that you are using.
axel.