[gmx-users] Silica Nanoparticles

[Kazem Sepehrinia]

Dear Mehmet,

Thank you for replying.

-Kazem


On Tue, Apr 22, 2014 at 2:07 PM, Suzen, Mehmet <msuzen at gmail.com> wrote:

> You may try to use special potential designed for amorphous silica:
>
> A numerical investigation of the liquid–vapor coexistence curve of silica
> Yves Guissani and Bertrand Guillot
> J. Chem. Phys. 104, 7633 (1996)
>
>
>
> On 22 April 2014 17:12, Kazem Sepehrinia <ksepehrinia at gmail.com> wrote:
> > Hi Dear All,
> >
> > Have any of you guys prepared silica nanoparticles in your Molecular
> > Simulation studies? I used some open databases for obtaining of bulk
> > amorphous silica file. But i'm not able to prepare silica nanoparticles.
> > Once again i used materials studio glasses and made a nanoparticle but
> that
> > one is not working also. Because i tried to minimize it and job failed.
> Any
> > help would be greatly appreciated.
> >
> > Thanks,
> > Kazem Sepehrinia.
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