Dear All,
I am wondering why MSD doesn't show a rational behaviour when increasing the pressure? I am simulating water permeation through graphene layers nanopore by varying the pressure. But, MSD vs time does show a weird manner with varying the pressure. For instance, MSD(P=2)>MSD(P=50)>MSD(P=10)>MSD(P=38). Please find the attached.
I don't think this makes sense.
Any comment would be highly appreciated.
Thanks in advance