ali.alizadehmojarad at gmail.com
Wed Oct 31 18:23:36 CET 2012
Dear All users
I have a system that contains water , methane and propane in 240 k and 300
My simulation box is rectangular .
Water film is in middle of my box. Methane and propane is around it.
My simulation box is symmetric,
1- I used g_rdf program for . My result is exotic. My g(r) in profile do
not reach to ! Why
2- I test my number density profiles(from g_density) but they do not
correct result because when i
calculate number of my molecules by multiplying volume to average number
density, i can not take the same number of my particle,
Where do i mistake?
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