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From chemistry-request@ccl.net Wed Mar  8 14:17:03 1995
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Date: Wed, 8 Mar 1995 13:25:59 -0500 (EST)
From: Gustavo Mercier 
To: Teerakiat Kerdcharoen 
cc: chemistry@ccl.net
Subject: CCL:Car-Parinello MD, available ?
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Hi!

Here is the info on the CP program on the net:

ftp: 141.14.129.9

file is /pub/physics/fhi93cp/fhi93cp.tar.Z

The authors are Stumpf and Scheffer from the Fritz - Haber - Institut der
Max - Planck - Gesellschaft, Berlin, Germany.

A document describing the program is available with the tar file. It is in
TeX. Currently, it runs in Unix boxes, but the source code is also supplied
in the tar file (Fortran 77). The program uses plane waves and can only
handel s and p pseudopotentials.

Another CP program is available from Japan, CAMP ATAMI, and its description
is available in the CCL files accessible through the net.

Cheers!

Gustavo A. Mercier, Jr.
mercie@mail.med.cornell.edu

On Wed, 8 Mar 1995, Teerakiat Kerdcharoen wrote:

> Dear cyberchemists,
> 	Once ago, I saw a post asking about the availability of
> Car-Parrinello MD program on the net. It has long been silent.
> Please if somebody knows, please keep us informed about that.
> 	Thanks a lot in advance.
> 						take care,
> 						Teerakiat
> -------------------------------------------------------------------------
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Modified: Fri Mar 10 17:00:00 1995 GMT
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