From owner-chemistry@ccl.net Wed Dec 1 11:51:01 2010 From: "Sanjay Bharathwaj computationalchemist()gmail.com" To: CCL Subject: CCL: Periodic System - semi empirical methods Message-Id: <-43249-101201114843-26711-vayRbmlatS9mjA8q/njIMQ^server.ccl.net> X-Original-From: Sanjay Bharathwaj Content-Type: multipart/alternative; boundary=0016e646504e93fd9004965c138c Date: Wed, 1 Dec 2010 17:48:36 +0100 MIME-Version: 1.0 Sent to CCL by: Sanjay Bharathwaj [computationalchemist]![gmail.com] --0016e646504e93fd9004965c138c Content-Type: text/plain; charset=ISO-8859-1 Dear Friends, I would like to know about the programmes that can handle periodic boundary conditions using semi empirical methods. I know MOPAC2009 could do that, but i find it difficult to find the documentation. In this regards, could any one help me to find something similar if available for free. -- Regards, Dr. Sanjay Bharathwaj Kumar, Dharmendra Institute of Technology, India. --0016e646504e93fd9004965c138c Content-Type: text/html; charset=ISO-8859-1 Content-Transfer-Encoding: quoted-printable Dear Friends,

I would like to know about the=A0programme= s=A0that can handle periodic boundary
conditions using semi empir= ical methods.

I know MOPAC2009 could do that, but = i find it difficult to find the documentation.
In this regards, could any one help me to find something similar if av= ailable for free.


--
Regards,Dr. Sanjay Bharathwaj Kumar,
Dharmendra Institute of Technology,
India.
--0016e646504e93fd9004965c138c--