Justin, thank you very much for your time and help. I am using pbc = xy
(with two walls, one on each side), but my box actually expands wildly,
which is very strange, rather than contracting and compressing the vacuum
regions. So I am not sure what to think. Maybe I should switch to pbc =
xyz
Andrew DeYoung wrote:
Justin, thank you very much for your time and help. I am using pbc = xy
(with two walls, one on each side), but my box actually expands wildly,
which is very strange, rather than contracting and compressing the vacuum
regions. So I am not sure what to think. Maybe I
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