[Pw_forum] How to control temperature in vc-md or vc-relax runs?

Huiqun Zhou hqzhou at nju.edu.cn
Fri Mar 3 12:19:29 CET 2006


list-users,

I have tried several vc-md and vc-relax runs, but found that the temperature
went very high even though I had set tempw to 300 and ion_temperature equal 
to
'rescaling'.

Could anyone give me a pointer what other options I need to set for 
controlling
temperature?

Huiqun Zhou 




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