30 December 2015 3 2K Report

Dear all,

I want to calculate friction coefficient of water in cnt using Green-Kubo relation. it uses the friction force autocorrelation function, but i don't know how to define force for it. which compute or fix should i use to calculate force?

after that i could use fix ave/correlate to calculate friction coefficient, but my problem is about calculating of Force?

any idea is appreciated.

Thanks

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