Hi Umut,
That "warning" is OK. I would suggest to check the density of your system to make sure it stays at a reasonable value.
Best,
Taisung
"MC Barostat: Decreasing size of volume moves" and,
"MC Barostat: 5000 volume changes attempted.
| MC Barostat: 1372 changes successful ( 27.44%)"
I have never used MC barostat; thus, I assume these warnings/info are inherent to the MC. Are these warnings normal?
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Received on Fri Feb 26 2021 - 10:30:01 PST
