Excuse me,
I would like to adjust the atoms’ temperature of specified group1, to stay the same with temperature of group2.
Group 1 and 2 do not connect with each other. Meanwhile, the temperature of group2 varies every time step.
Could you please tell me which command can be used to achieve this?
Thank you very much!
Youwei
Excuse me,
I would like to adjust the atoms’ temperature of specified group1, to stay the same with temperature of group2.
What would be the use of that?
Group 1 and 2 do not connect with each other. Meanwhile, the
Which makes your request even more questionable.
temperature of group2 varies every time step.
Why should it not fluctuate? It is only a small number of atoms. For a truly constant temperature you need an infinite number of atoms.
Could you please tell me which command can be used to achieve this?
You can attach two thermostats, one to each group.