Hi, all gmx-users, I was simulating a CCl4 surface system. I encounter some problems. I hope for your help. First I built a 3x3x3 nm3 CCl4 box, then solved it into a 3x3x15 box in order to form gas/CCl4/gas surface system. After simulating in NVT, two CCl4 molecules run away to the gas phase. I want to know how to control CCl4 not to run to gas phase. I used the gromos96 force field. Can you help me? I expect your answer. Thanks a lot!
H. Y. Xiao
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