Hello all,
I'm trying to understand how we can combine the Forward Flux sampling method with LAMMPS to obtain ice nucleation rates using mW potential of water?
I do not understand if this is performed through LAMMPS itself or through a separate application and if so how is it applied in practice.
This method has been described in many publications but how FFS is used and which software is deployed for it is never clearly explained - maybe because it is directly understood but I cannot figure it out !
Any insight is appreciated. Thanks.
Hi Abhay,
I think what you are specifically asking for is given in this tutorial:
https://ssagesproject.github.io/docs/Forward-Flux.html
This site also gives a very good description of the method as well.
Hope that helps.
Thanks,
Jeet
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