[DFTB-Plus-User] Fwd: MoS2 parameters

SRKC Sharma Yamijala sharmajncasr at gmail.com
Tue Mar 10 17:46:54 CET 2015


********************************************************
*Chaitanya Sharma,*
*Prof. Pati'*s group,
Chemistry and Physics Materials unit,
JNCASR, BANGLORE,
Lab:: (080-2208) 2581, 2809
https://sites.google.com/site/sharmasrkcyamijala/
*********************************************************

---------- Forwarded message ----------
From: SRKC Sharma Yamijala <sharmajncasr at gmail.com>
Date: Tue, Mar 10, 2015 at 5:19 PM
Subject: Re: MoS2 parameters
To: dftb-plus-user at dftb-plus.info


Hi all,
This is just a gentle reminder in case any body know the answer.

Thanks,
Sharma.








********************************************************
*Chaitanya Sharma,*
*Prof. Pati'*s group,
Chemistry and Physics Materials unit,
JNCASR, BANGLORE,
Lab:: (080-2208) 2581, 2809
https://sites.google.com/site/sharmasrkcyamijala/
*********************************************************

On Sun, Mar 8, 2015 at 1:11 PM, SRKC Sharma Yamijala <sharmajncasr at gmail.com
> wrote:

> Dear all,
>
> Below website suggests that there are parameters for MoS2 on the DFTB
> website. Though I am registered user, I couldn't find any such parameters
> there. Does any body know how to get these parameters.
>
> http://quantumwise.com/publications/tutorials/item/100-mos2-nanotubes
>
> Thanking you,
> Sincerely,
> Sharma.
>
>
>
>
>
> ********************************************************
> *Chaitanya Sharma,*
> *Prof. Pati'*s group,
> Chemistry and Physics Materials unit,
> JNCASR, BANGLORE,
> Lab:: (080-2208) 2581, 2809
> https://sites.google.com/site/sharmasrkcyamijala/
> *********************************************************
>
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