From owner-chemistry ^%at%^ ccl.net Tue Dec  4 08:18:01 2007
From: "senthil nathan zenthil03^yahoo.co.in" <owner-chemistry_+_server.ccl.net>
To: CCL
Subject: CCL: For file conversion in ADF-reg
Message-Id: <-35762-071204081434-24282-gvYzmRPICXn7A6GVaHdnhA_+_server.ccl.net>
X-Original-From: "senthil  nathan" <zenthil03^^^yahoo.co.in>
Date: Tue, 4 Dec 2007 08:14:29 -0500


Sent to CCL by: "senthil  nathan" [zenthil03[-]yahoo.co.in]
Dear CCLrs,
            In connection with my privious question, I want to do fragment analysis for particular system. My total chemical system is neutral, but its fragment is charged species. I have done a calculation for both the fragment files separatly and I have two TAPE21 file for my fragments. For total fragment analysis I want to read some basic results form TAPE21 fragment file. Now I am using ADF trial windows version, in this version TAPE21 file will be a binary result file. I want to do this fragment TAPE21 file as input file for total fragment analysis. I unable to convert this binary file as a ADF input file. Any one of you tell me a better solution for my problem.

thanking you inadvance
best wishes from
Senthilnathan