Trying to simulate a ice-PTFE interaction and am unable to find a reference which actually lists out forcefield parameters for PTFE-PTFE interactions using ReaxFF or even other force fields like Dreidig, Tersoff etc. Any help is appreciated.
T. P M Goumans
this may be a good starting point:
A.Rahnamoun and A.C.T. van Duin Reactive Molecular Dynamics Simulation on the Disintegration of Kapton, POSS Polyimide, Amorphous Silica, and Teflon during Atomic Oxygen Impact Using the Reaxff Reactive Force-Field Method J. Phys. Chem. A, 2014, 118 (15), pp 2780-2787
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