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Possible issues with volume when switching from NPT to NVT #2

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chrisjonesBSU opened this issue Jan 27, 2023 · 0 comments
Open

Possible issues with volume when switching from NPT to NVT #2

chrisjonesBSU opened this issue Jan 27, 2023 · 0 comments
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Switching from NVT to NPT run methods seems to work fine, the box starts to fluctuate during the NPT run. However, when switching back to NVT from NPT, it looks like the box abruptly changes from those typical of the NPT run back to what it was during the first NVT run.
@chrisjonesBSU chrisjonesBSU self-assigned this Jan 27, 2023
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