[gmx-users] carbon nanotube - ifnite in length ?

[Justin Lemkul]

On 10/10/13 10:01 AM, Steven Neumann wrote:
> Thanks a lot. I will use position restraints then with a strong force
> constant, no bonds and place the edge atoms within half of distance between
> them from the box edge. Is that correct?
>

Seems reasonable.  One way to find out...

-Justin

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Justin A. Lemkul, Ph.D.
Postdoctoral Fellow

Department of Pharmaceutical Sciences
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jalemkul at outerbanks.umaryland.edu | (410) 706-7441

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