[Towhee-users] silt pore with hard wall and markov chain control
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marcus_martin
From: Shi, J. <sh...@ma...> - 2016-01-30 06:44:09
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Hi there, I got some hint on setting slit pore using hard walls separations from previous postings. However, the thickness of the hard walls increased the volume of the simulation box a lot if the slit pores are very narrow. Since the probability of accepted MC moves will be affected by the box volume, I worry we might get a systematic error here. Thank you in advance for sharing your thoughts. Regards, Jingbo Wood Science department University of British Columbia |