Message -
From: ZARA NBSH
To: siesta-l@uam.es
Sent: Fri, 20 May 2016 20:43:05 +0430 (IRDT)
Subject: Re: [SIESTA-L] Simulating graphene ripples using siesta MD
Hi Pouya,
Thank you very much for your answer.
I read your paper and I have a question.
As much as I now in ab-initio MD, the number of
cture and electronic properties in
> rippled free-standing graphene. Physical Review B, 83(16), 165434 (2011).
>
> Best,
> Pouya
>
>
> - Original Message -
> From: "ZARA NBSH"
> To: siesta-l@uam.es
> Sent: Tuesday, May 17, 2016 9:34:57 AM
>
"
To: siesta-l@uam.es
Sent: Tuesday, May 17, 2016 9:34:57 AM
Subject: [SIESTA-L] Simulating graphene ripples using siesta MD
Dear all,
I would like to simulate the graphene ripples using molecular dynamics.
Can I use MD package of siesta to do that?
Best regards,
Zara
Thanks,
How many atoms can I have in my simulation?
Can I study adsorption of atoms on graphene surface using MD?
Would you please give me a good reference of MD simulation of siesta
Best regards,
Zara
On Tue, May 17, 2016 at 12:22 PM, Emilio Artacho wrote:
> yes
>
> On May 17, 2016, at 9:34
yes
> On May 17, 2016, at 9:34 AM, ZARA NBSH wrote:
>
> Dear all,
> I would like to simulate the graphene ripples using molecular dynamics.
> Can I use MD package of siesta to do that?
>
> Best regards,
> Zara
--
Emilio Artacho
CIC nanoGUNE Consolider, and Cavendish Laboratory, University of
Dear all,
I would like to simulate the graphene ripples using molecular dynamics.
Can I use MD package of siesta to do that?
Best regards,
Zara
