Dear Experts, Hi and Happy New Year.
I am experiencing that using Nose thermostat in cp.x is somehow fails to control T and I have a large deviations from the target T even using fnosep in the midway of natural ionic frequencies. On the other hand, "rescaling" is quite successful. Which point should I take care in order to have successful results with Nose. I had also used chain to respect ergodicity. Any comments is highly appreciated. Best regards, Mahmoud --------------------------------------- Mahmoud Payami NSTRI, AEOI, Tehran, Iran Email: [email protected] Phone: +98 (0)21 82066504 --------------------------------------------------------
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