From owner-chemistry#* at *#ccl.net Wed Mar 23 11:31:00 2011
From: "vihar vihgeo|*|chem.gla.ac.uk" <owner-chemistry+/-server.ccl.net>
To: CCL
Subject: CCL: electron transport
Message-Id: <-44183-110323100307-472-gK1ftkuwBwW0CU+N/IJaxg+/-server.ccl.net>
X-Original-From: vihar <vihgeo=-=chem.gla.ac.uk>
Content-Transfer-Encoding: 7bit
Content-Type: text/plain; charset=ISO-8859-1; format=flowed
Date: Wed, 23 Mar 2011 14:03:48 +0000
MIME-Version: 1.0


Sent to CCL by: vihar [vihgeo::chem.gla.ac.uk]
Hi Neeraj,
they are few free programs such as:

Smeagol:
http://www.smeagol.tcd.ie/

Siesta:
http://www.icmab.es/siesta/

gDFTB:
http://icode.eln.uniroma2.it/tools/simulators/gdftb

Probably they are few more but all of them are similar.

The commercials software is very nice and it can be downloaded from :

http://quantumwise.com/

I hope that this information will be helpful for you.

Regards,
Vihar

On 23/03/11 05:44, neeraj misra neerajmisra^^hotmail.com wrote:
> Sent to CCL by: "neeraj  misra" [neerajmisra(-)hotmail.com]
>
> Dear All,
> How to study the electron transport in a doped fullerene,, any free software ? I mean the bias dependent electron transmission and current.
>
> Thanks in advance
> NM>
>