Changing the atomtype of a particle on the fly

From: BIN ZHANG (zhngbn_at_gmail.com)
Date: Fri Oct 02 2009 - 01:15:07 CDT

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Dear All:

Is it possible to change the atom type of a particle on the fly
without stopping the simulation? Say, after one ns simulation, I want
to change the parameter for a particular particle (alternating the
parameter for LJ balls).

Any suggestions is appreciated.

Thanks,
Bin

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• Next in thread: Sridhar Vaddadi: "error termination"
• Reply: Sridhar Vaddadi: "error termination"
• Reply: Philip Peartree: "Minimisation Protocol"
• Reply: Axel Kohlmeyer: "Re: Changing the atomtype of a particle on the fly"
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