[gmx-users] oplsaa for graphene

[Tom]

i want to use opls aa to simulate graphene sheet.

As recommended by gromacs website about nice work of Andrea Minoia'stutorial
http://chembytes.wikidot.com/grocnt

That set of forcefield was taken from opls-aa and was established for
graphene
and CNT years ago.

Does anyone with experience of Graphene simulation have any comment about
that
set of parameters?
it seems to me that the graphene sheet does not have enough curvature like
what it
is supposed to have.

Thanks for the comment or suggestions for better parameters.

Thomas